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Product No: AB0549

Thymidine, 98%

Name: Thymidine
Brand: Chempure

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CAS Number

50-89-5

Molecular Weight

242.23

Formula

C10H14N2O5

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IUPAC name	1-[(2R,4S,5R)-4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]-5-methylpyrimidine-2,4-dione
canonical smiles	CC1=CN(C(=O)NC1=O)C2CC(C(O2)CO)O
inchi	InChI=1S/C10H14N2O5/c1-5-3-12(10(16)11-9(5)15)8-2-6(14)7(4-13)17-8/h3,6-8,13-14H,2,4H2,1H3,(H,11,15,16)/t6-,7+,8+/m0/s1
inchi key	IQFYYKKMVGJFEH-XLPZGREQSA-N
molecular formula	C10H14N2O5
synonyms	thymidine 50-89-5 deoxythymidine 2'-Deoxythymidine Thymidin
Compound Description	Thymidine is a pyrimidine 2'-deoxyribonucleoside having thymine as the nucleobase. It has a role as a metabolite, a human metabolite, an Escherichia coli metabolite and a mouse metabolite. It is functionally related to a thymine. It is an enantiomer of a telbivudine. Thymidine is a pyrimidine deoxynucleoside. Thymidine is the DNA nucleoside T, which pairs with deoxyadenosine in double-stranded DNA. In cell biology it is used to synchronize the cells in S phase. Thymidine is a metabolite found in or produced by Escherichia coli . Thymidine is a natural product found in Streptomyces piomogenus, Peucedanum japonicum, and other organisms with data available. Thymidine is a pyrimidine nucleoside that is composed of the pyrimidine base thymine attached to the sugar deoxyribose. As a constituent of DNA, thymidine pairs with adenine in the DNA double helix. Thymidine is a metabolite found in or produced by Saccharomyces cerevisiae. A nucleoside in which THYMINE is linked to DEOXYRIBOSE.

Computed Properties

Molecular Weight:	242.23 g/mol
XLogP3:	-1.2
Hydrogen Bond Donor Count:	3
Hydrogen Bond Acceptor Count:	5
Rotatable Bond Count:	2
Exact Mass:	242.09027155 g/mol
Monoisotopic Mass:	242.09027155 g/mol
Topological Polar Surface Area:	99.1 Å²
Heavy Atom Count:	17
Formal Charge:	0
Complexity:	381
Isotope Atom Count:	0
Defined Atom Stereocenter Count:	3
Undefined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
Covalently-Bonded Unit Count:	1
Compound Is Canonicalized:	Yes

Related Compounds

Floxuridine

6-Azauridine

Cytarabine

Zalcitabine

Zidovudine

Gemcitabine

Idoxuridine

Uridine

5-Bromo-2'-deoxyuridine

Thymidine

Trifluridine

2'-Deoxycytidine

2'-Deoxyuridine

Stavudine

Telbivudine

hazard signal	Danger
hazard classes and categories	Acute Tox. 4 (66.67%) Skin Irrit. 2 (33.33%) Eye Irrit. 2A (33.33%) STOT SE 3 (66.67%) Muta. 1A (33.33%)
precautionary statement codes	P203, P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P318, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501
hazard statements	H302 (66.67%): Harmful if swallowed [Warning Acute toxicity, oral] H315 (33.33%): Causes skin irritation [Warning Skin corrosion/irritation] H319 (33.33%): Causes serious eye irritation [Warning Serious eye damage/eye irritation] H335 (66.67%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation] H340 (33.33%): May cause genetic defects [Danger Germ cell mutagenicity] H341 (33.33%): Suspected of causing genetic defects [Warning Germ cell mutagenicity]
hazards summary	Causes somnolence and changes in motor activity in intraperitoneal lethal-dose studies of mice (LD50 = 2,512 mg/kg). May cause irritation.

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Certificate of Analysis

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*This document is like a lab demo—an example Certificate of Analysis (COA) that showcases what a COA looks like but may not match the latest batch in all its glory. Think of it as a chemistry experiment: close, but not quite the final reaction!

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About this item

IUPAC name	1-[(2R,4S,5R)-4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]-5-methylpyrimidine-2,4-dione
canonical smiles	CC1=CN(C(=O)NC1=O)C2CC(C(O2)CO)O
inchi	InChI=1S/C10H14N2O5/c1-5-3-12(10(16)11-9(5)15)8-2-6(14)7(4-13)17-8/h3,6-8,13-14H,2,4H2,1H3,(H,11,15,16)/t6-,7+,8+/m0/s1
inchi key	IQFYYKKMVGJFEH-XLPZGREQSA-N
molecular formula	C10H14N2O5
synonyms	thymidine 50-89-5 deoxythymidine 2'-Deoxythymidine Thymidin
Compound Description	Thymidine is a pyrimidine 2'-deoxyribonucleoside having thymine as the nucleobase. It has a role as a metabolite, a human metabolite, an Escherichia coli metabolite and a mouse metabolite. It is functionally related to a thymine. It is an enantiomer of a telbivudine. Thymidine is a pyrimidine deoxynucleoside. Thymidine is the DNA nucleoside T, which pairs with deoxyadenosine in double-stranded DNA. In cell biology it is used to synchronize the cells in S phase. Thymidine is a metabolite found in or produced by Escherichia coli . Thymidine is a natural product found in Streptomyces piomogenus, Peucedanum japonicum, and other organisms with data available. Thymidine is a pyrimidine nucleoside that is composed of the pyrimidine base thymine attached to the sugar deoxyribose. As a constituent of DNA, thymidine pairs with adenine in the DNA double helix. Thymidine is a metabolite found in or produced by Saccharomyces cerevisiae. A nucleoside in which THYMINE is linked to DEOXYRIBOSE.

Computed Properties

Molecular Weight:	242.23 g/mol
XLogP3:	-1.2
Hydrogen Bond Donor Count:	3
Hydrogen Bond Acceptor Count:	5
Rotatable Bond Count:	2
Exact Mass:	242.09027155 g/mol
Monoisotopic Mass:	242.09027155 g/mol
Topological Polar Surface Area:	99.1 Å²
Heavy Atom Count:	17
Formal Charge:	0
Complexity:	381
Isotope Atom Count:	0
Defined Atom Stereocenter Count:	3
Undefined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
Covalently-Bonded Unit Count:	1
Compound Is Canonicalized:	Yes

Related Compounds

Floxuridine

6-Azauridine

Cytarabine

Zalcitabine

Zidovudine

Gemcitabine

Idoxuridine

Uridine

5-Bromo-2'-deoxyuridine

Thymidine

Trifluridine

2'-Deoxycytidine

2'-Deoxyuridine

Stavudine

Telbivudine

hazard signal	Danger
hazard classes and categories	Acute Tox. 4 (66.67%) Skin Irrit. 2 (33.33%) Eye Irrit. 2A (33.33%) STOT SE 3 (66.67%) Muta. 1A (33.33%)
precautionary statement codes	P203, P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P318, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501
hazard statements	H302 (66.67%): Harmful if swallowed [Warning Acute toxicity, oral] H315 (33.33%): Causes skin irritation [Warning Skin corrosion/irritation] H319 (33.33%): Causes serious eye irritation [Warning Serious eye damage/eye irritation] H335 (66.67%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation] H340 (33.33%): May cause genetic defects [Danger Germ cell mutagenicity] H341 (33.33%): Suspected of causing genetic defects [Warning Germ cell mutagenicity]
hazards summary	Causes somnolence and changes in motor activity in intraperitoneal lethal-dose studies of mice (LD50 = 2,512 mg/kg). May cause irritation.

Product No: AB0549

Thymidine, 98%

Product No: AB0549

About this item

NAME AND IDENTIFIERS

CHEMICAL AND PHYSICAL PROPERTIES

Related Compounds

SAFETY AND HAZARDS

About this item

Documentation

Certificate of Analysis

Require a Sample Certificate of Analysis (COA) ?

Reviews

Product No: AB0549

About this item

NAME AND IDENTIFIERS

CHEMICAL AND PHYSICAL PROPERTIES

Related Compounds

SAFETY AND HAZARDS

Require a Sample Certificate of Analysis (COA) ?