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AG00IJQB

96-81-1 | N-Acetyl-L-Valine

AG00IJQB

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CAS Number	96-81-1
Catalog Number	AG00IJQB(AGN-PC-0WAEFC)
Chemical Name	N-Acetyl-L-Valine
EC Number	202-537-8
IUPAC Name	(2S)-2-acetamido-3-methylbutanoic acid
InChI	InChI=1S/C7H13NO3/c1-4(2)6(7(10)11)8-5(3)9/h4,6H,1-3H3,(H,8,9)(H,10,11)/t6-/m0/s1
InChI Key	IHYJTAOFMMMOPX-LURJTMIESA-N
MDL Number	MFCD00066066
Molecular Formula	C7H13NO3
Molecular Weight	159.1830
SMILES	CC(C)[C@@H](C(O)=O)NC(C)=O
UNII	U83P7H9HV3
Synonyms	acetyl-Val, N-acetyl-D,L-valine, N-Acetyl-DL-valine, N-acetylvaline, N-acetylvaline, (D)-isomer, N-acetylvaline, (L)-isomer, N-Acetyl-L-valine, 96-81-1, Ac-Val-OH, (S)-2-Acetamido-3-methylbutanoic acid, L-Valine, N-acetyl-, N-Acetylvaline, (2S)-2-acetamido-3-methylbutanoic acid, UNII-U83P7H9HV3, Valine, N-acetyl-, Valine, N-acetyl-, L-, U83P7H9HV3, Acetyl-L-Valine, IHYJTAOFMMMOPX-LURJTMIESA-N, MFCD00066066, Acetylvaline, N-Acetyl Valine, EINECS 202-537-8, AC1Q5JQI, N-alpha-Actetyl-L-valine, SCHEMBL132349, AC1L265W, CHEBI:21565, CTK1C3476, HMS1719J05, ZINC399365, KS-00000A8U, EINECS 221-321-4, ANW-40835, AKOS001078320, AKOS015837737, AM82366, CS-W016182, GS-3342, MCULE-4757813230, NSC 122016, RTR-032728, (S)-2-acetylamino-3-methylbutyric acid, NCGC00323030-01, AJ-21727, AN-42815, BR-47407, P905, SC-09987, (2S)-2-acetamido-3-methyl-butanoic acid, AB1007098, DB-057650, TR-032728, FT-0631495, ST24032094, M-3029, AB01318387-02, J-300293, W-100131, Z57032483, N-\|A-Actetyl-L-valine; (S)-2-Acetamido-3-Methylbutanoic acid; N-Acetyl-L-Valine extrapure for biochemistry, N-Acetyl-D-valine, N-Acetyl-DL-valine, C7H13NO3, C7-H13-N-O3, CID66789, AR-1K5770, ACN-033709, A2366, A-1897, 3067-19-4, 17916-88-0, 36185-10-1,

Complexity	165
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	1
Defined Bond Stereocenter Count	0
Exact Mass	159.09g/mol
Formal Charge	0
Heavy Atom Count	11
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	2
Isotope Atom Count	0
Molecular Weight	159.185g/mol
Monoisotopic Mass	159.09g/mol
Rotatable Bond Count	3
Topological Polar Surface Area	66.4A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	0

GHS Hazard and Precautionary Statements

Symbol:
Hazard statements	H315-H319-H335
Precuationary statements	P261-P305+P351+P338
Siginal words

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Conclusion: The above product meets the specifications of Angene.

Analyst:Chase

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Reviewed by:Jessie

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Angene International Limited