AG002YIH

29475-64-7 | D-Alanine, N-methyl-

AG002YIH

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CAS Number	29475-64-7
Catalog Number	AG002YIH(AGN-PC-0O8OEA)
Chemical Name	D-Alanine, N-methyl-
IUPAC Name	(2R)-2-(methylamino)propanoic acid
InChI	InChI=1S/C4H9NO2/c1-3(5-2)4(6)7/h3,5H,1-2H3,(H,6,7)/t3-/m1/s1
InChI Key	GDFAOVXKHJXLEI-GSVOUGTGSA-N
MDL Number	MFCD00063135
Molecular Formula	C4H9NO2
Molecular Weight	103.1198
SMILES	[H][C@](C)(NC)C(O)=O
UNII	06WZ7BZ0M4
Synonyms	N-methyl-D-alanine, 29475-64-7, D-Alanine, N-methyl-, (R)-2-(Methylamino)propanoic acid, H-D-MeAla-OH, H-N-Me-D-Ala-OH, (2R)-2-(methylamino)propanoic acid, UNII-06WZ7BZ0M4, 06WZ7BZ0M4, MFCD00063135, d-n-methylalanine, N-methyl-d-ala, N-Methylalanine, D-, AC1Q3XJO, AC1L3P7Y, KSC201S8D, SCHEMBL164982, CTK1A1981, C4H9N02, DTXSID70275905, GDFAOVXKHJXLEI-GSVOUGTGSA-N, ZINC3874422, ANW-41298, AKOS015850676, RTR-012810, AC-24129, AJ-46399, AS-19045, SC-45134, AB0031221, AB1007199, DB-049799, TR-012810, FT-0688071, ST24035263, X4228, M-3646, (2R)-2-(Methylamino)Propanoic Acid Hydrochloride, 475H647, UNII-FER5I9LLG2 component GDFAOVXKHJXLEI-GSVOUGTGSA-N, N-Methylalanine, null, n-alpha-methyl-d-alanine, CID92973, ACN-032924, MAA,

Complexity	72.1
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	1
Defined Bond Stereocenter Count	0
Exact Mass	103.063g/mol
Formal Charge	0
Heavy Atom Count	7
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	2
Isotope Atom Count	0
Molecular Weight	103.121g/mol
Monoisotopic Mass	103.063g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	49.3A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	-2.5

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302-H315-H319-H332-H335
Packing Group
Precautionary statements	P261-P280-P305+P351+P338
UN Code

Certificate of Analysis

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