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Product No: BA4572

2-{[(benzyloxy)carbonyl]amino}acetic acid, 95%

Name: 2-{[(benzyloxy)carbonyl]amino}acetic acid
Brand: Chempure
Rating: 4 (1 reviews)

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CAS Number

1138-80-3

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About this item

IUPAC name	2-(phenylmethoxycarbonylamino)acetic acid
canonical smiles	C1=CC=C(C=C1)COC(=O)NCC(=O)O
inchi	InChI=1S/C10H11NO4/c12-9(13)6-11-10(14)15-7-8-4-2-1-3-5-8/h1-5H,6-7H2,(H,11,14)(H,12,13)
inchi key	CJUMAFVKTCBCJK-UHFFFAOYSA-N
molecular formula	C10H11NO4
synonyms	1138-80-3 N-Carbobenzyloxyglycine Z-Gly-OH N-CBZ-glycine N-Benzyloxycarbonylglycine
Compound Description	N-benzyloxycarbonylglycine is a derivative of glycine having a benzyloxycarbonyl protecting group attached to the nitrogen. It is a conjugate acid of a N-benzyloxycarbonylglycinate. N-Benzyloxycarbonylglycine is a natural product found in Phaseolus vulgaris with data available.

Computed Properties

Molecular Weight:	209.20 g/mol
XLogP3:	1
Hydrogen Bond Donor Count:	2
Hydrogen Bond Acceptor Count:	4
Rotatable Bond Count:	5
Exact Mass:	209.06880783 g/mol
Monoisotopic Mass:	209.06880783 g/mol
Topological Polar Surface Area:	75.6 Å²
Heavy Atom Count:	15
Formal Charge:	0
Complexity:	224
Isotope Atom Count:	0
Defined Atom Stereocenter Count:	0
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

Felbinac

Thiorphan

Phenylpropionylglycine

Phe-gly

Phe-ala

5-Phenylpenta-2,4-dienoic acid

N-Benzyloxycarbonylglycine

N-Carbobenzoxy-DL-valine

Benzyl (cyanomethyl)carbamate

Cinnamoylglycine

3-(2-Quinolinyl)acrylic acid

N-[(Benzyloxy)carbonyl]-L-alanine

2-(Phenylsulfonamido)acetic Acid

Benzyl N-(2-hydroxyethyl)carbamate

2-(4-Methoxybenzamido)acetic acid

hazard signal	Warning
hazard classes and categories	Skin Irrit. 2 (100%) Eye Irrit. 2A (100%) STOT SE 3 (100%)
precautionary statement codes	P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501
hazard statements	H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation] H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation] H335 (100%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation]
hazards summary	An irritant. Reproductive effects observed in experimental animals.

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About this item

Documentation

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	2-(phenylmethoxycarbonylamino)acetic acid
canonical smiles	C1=CC=C(C=C1)COC(=O)NCC(=O)O
inchi	InChI=1S/C10H11NO4/c12-9(13)6-11-10(14)15-7-8-4-2-1-3-5-8/h1-5H,6-7H2,(H,11,14)(H,12,13)
inchi key	CJUMAFVKTCBCJK-UHFFFAOYSA-N
molecular formula	C10H11NO4
synonyms	1138-80-3 N-Carbobenzyloxyglycine Z-Gly-OH N-CBZ-glycine N-Benzyloxycarbonylglycine
Compound Description	N-benzyloxycarbonylglycine is a derivative of glycine having a benzyloxycarbonyl protecting group attached to the nitrogen. It is a conjugate acid of a N-benzyloxycarbonylglycinate. N-Benzyloxycarbonylglycine is a natural product found in Phaseolus vulgaris with data available.

Computed Properties

Molecular Weight:	209.20 g/mol
XLogP3:	1
Hydrogen Bond Donor Count:	2
Hydrogen Bond Acceptor Count:	4
Rotatable Bond Count:	5
Exact Mass:	209.06880783 g/mol
Monoisotopic Mass:	209.06880783 g/mol
Topological Polar Surface Area:	75.6 Å²
Heavy Atom Count:	15
Formal Charge:	0
Complexity:	224
Isotope Atom Count:	0
Defined Atom Stereocenter Count:	0
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

Felbinac

Thiorphan

Phenylpropionylglycine

Phe-gly

Phe-ala

5-Phenylpenta-2,4-dienoic acid

N-Benzyloxycarbonylglycine

N-Carbobenzoxy-DL-valine

Benzyl (cyanomethyl)carbamate

Cinnamoylglycine

3-(2-Quinolinyl)acrylic acid

N-[(Benzyloxy)carbonyl]-L-alanine

2-(Phenylsulfonamido)acetic Acid

Benzyl N-(2-hydroxyethyl)carbamate

2-(4-Methoxybenzamido)acetic acid

hazard signal	Warning
hazard classes and categories	Skin Irrit. 2 (100%) Eye Irrit. 2A (100%) STOT SE 3 (100%)
precautionary statement codes	P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501
hazard statements	H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation] H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation] H335 (100%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation]
hazards summary	An irritant. Reproductive effects observed in experimental animals.

Product No: BA4572

2-{[(benzyloxy)carbonyl]amino}acetic acid, 95%

Product No: BA4572

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: BA4572

About this item

NAME AND IDENTIFIERS

CHEMICAL AND PHYSICAL PROPERTIES

Related Compounds

SAFETY AND HAZARDS

Require a Sample Certificate of Analysis (COA) ?