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Product No: CL6788

(2S)-2-({[(9H-fluoren-9-yl)methoxy]carbonyl}amino)-3-methylbutanoic acid, 95%

Name: (2S)-2-({[(9H-fluoren-9-yl)methoxy]carbonyl}amino)-3-methylbutanoic acid
Brand: Chempure

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CAS Number

68858-20-8

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About this item

IUPAC name	(2S)-2-(9H-fluoren-9-ylmethoxycarbonylamino)-3-methylbutanoic acid
canonical smiles	CC(C)C(C(=O)O)NC(=O)OCC1C2=CC=CC=C2C3=CC=CC=C13
inchi	InChI=1S/C20H21NO4/c1-12(2)18(19(22)23)21-20(24)25-11-17-15-9-5-3-7-13(15)14-8-4-6-10-16(14)17/h3-10,12,17-18H,11H2,1-2H3,(H,21,24)(H,22,23)/t18-/m0/s1
inchi key	UGNIYGNGCNXHTR-SFHVURJKSA-N
molecular formula	C20H21NO4
synonyms	Fmoc-L-valine 68858-20-8 Fmoc-Val-OH Fmoc-L-Val-OH N-Fmoc-L-valine

Computed Properties

Molecular Weight:	339.4 g/mol
XLogP3:	4
Hydrogen Bond Donor Count:	2
Hydrogen Bond Acceptor Count:	4
Rotatable Bond Count:	6
Exact Mass:	339.14705815 g/mol
Monoisotopic Mass:	339.14705815 g/mol
Topological Polar Surface Area:	75.6 Å²
Heavy Atom Count:	25
Formal Charge:	0
Complexity:	470
Isotope Atom Count:	0
Defined Atom Stereocenter Count:	1
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

Fmoc-L-leucine

Fmoc-D-Leu-OH

Fmoc-Lys(Boc)-OH

Fmoc-L-isoleucine

6-((((9H-Fluoren-9-yl)methoxy)carbonyl)amino)hexanoic acid

Fmoc-L-valine

2-(9H-fluoren-9-ylmethoxycarbonylamino)-4-methylpentanoic acid

Fmoc-Ala-OH

Fmoc-beta-alanine

Fmoc-Gly-OH

(R)-2-((((9H-Fluoren-9-yl)methoxy)carbonyl)amino)-3-cyclohexylpropanoic acid

Fmoc-L-phenylalanine

Fmoc-D-phenylalanine

N-(((2,7-Dimethyl-9H-fluoren-9-yl)methoxy)carbonyl)-L-leucine

Fmoc-Asp(OtBu)-OH

hazard signal	Warning
hazard classes and categories	Skin Irrit. 2 (50%) Eye Irrit. 2A (50%) STOT SE 3 (50%)
precautionary statement codes	P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P317, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501
hazard statements	H302 (50%): Harmful if swallowed [Warning Acute toxicity, oral] H312 (50%): Harmful in contact with skin [Warning Acute toxicity, dermal] H315 (50%): Causes skin irritation [Warning Skin corrosion/irritation] H319 (50%): Causes serious eye irritation [Warning Serious eye damage/eye irritation] H332 (50%): Harmful if inhaled [Warning Acute toxicity, inhalation] H335 (50%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation]
hazards summary	Not considered hazardous by GHS classification.

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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	(2S)-2-(9H-fluoren-9-ylmethoxycarbonylamino)-3-methylbutanoic acid
canonical smiles	CC(C)C(C(=O)O)NC(=O)OCC1C2=CC=CC=C2C3=CC=CC=C13
inchi	InChI=1S/C20H21NO4/c1-12(2)18(19(22)23)21-20(24)25-11-17-15-9-5-3-7-13(15)14-8-4-6-10-16(14)17/h3-10,12,17-18H,11H2,1-2H3,(H,21,24)(H,22,23)/t18-/m0/s1
inchi key	UGNIYGNGCNXHTR-SFHVURJKSA-N
molecular formula	C20H21NO4
synonyms	Fmoc-L-valine 68858-20-8 Fmoc-Val-OH Fmoc-L-Val-OH N-Fmoc-L-valine

Computed Properties

Molecular Weight:	339.4 g/mol
XLogP3:	4
Hydrogen Bond Donor Count:	2
Hydrogen Bond Acceptor Count:	4
Rotatable Bond Count:	6
Exact Mass:	339.14705815 g/mol
Monoisotopic Mass:	339.14705815 g/mol
Topological Polar Surface Area:	75.6 Å²
Heavy Atom Count:	25
Formal Charge:	0
Complexity:	470
Isotope Atom Count:	0
Defined Atom Stereocenter Count:	1
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

Fmoc-L-leucine

Fmoc-D-Leu-OH

Fmoc-Lys(Boc)-OH

Fmoc-L-isoleucine

6-((((9H-Fluoren-9-yl)methoxy)carbonyl)amino)hexanoic acid

Fmoc-L-valine

2-(9H-fluoren-9-ylmethoxycarbonylamino)-4-methylpentanoic acid

Fmoc-Ala-OH

Fmoc-beta-alanine

Fmoc-Gly-OH

(R)-2-((((9H-Fluoren-9-yl)methoxy)carbonyl)amino)-3-cyclohexylpropanoic acid

Fmoc-L-phenylalanine

Fmoc-D-phenylalanine

N-(((2,7-Dimethyl-9H-fluoren-9-yl)methoxy)carbonyl)-L-leucine

Fmoc-Asp(OtBu)-OH

hazard signal	Warning
hazard classes and categories	Skin Irrit. 2 (50%) Eye Irrit. 2A (50%) STOT SE 3 (50%)
precautionary statement codes	P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P317, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501
hazard statements	H302 (50%): Harmful if swallowed [Warning Acute toxicity, oral] H312 (50%): Harmful in contact with skin [Warning Acute toxicity, dermal] H315 (50%): Causes skin irritation [Warning Skin corrosion/irritation] H319 (50%): Causes serious eye irritation [Warning Serious eye damage/eye irritation] H332 (50%): Harmful if inhaled [Warning Acute toxicity, inhalation] H335 (50%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation]
hazards summary	Not considered hazardous by GHS classification.

Product No: CL6788

(2S)-2-({[(9H-fluoren-9-yl)methoxy]carbonyl}amino)-3-methylbutanoic acid, 95%

Product No: CL6788

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: CL6788

About this item

NAME AND IDENTIFIERS

CHEMICAL AND PHYSICAL PROPERTIES

Related Compounds

SAFETY AND HAZARDS

Require a Sample Certificate of Analysis (COA) ?