AG007DDT

1119-48-8 | 4-(Methylamino)butyric acid

AG007DDT

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CAS Number	1119-48-8
Catalog Number	AG007DDT(AGN-PC-07Y4PV)
Chemical Name	4-(Methylamino)butyric acid
IUPAC Name	4-(methylamino)butanoic acid
InChI	InChI=1S/C5H11NO2/c1-6-4-2-3-5(7)8/h6H,2-4H2,1H3,(H,7,8)
InChI Key	AOKCDAVWJLOAHG-UHFFFAOYSA-N
MDL Number	MFCD00044627
Molecular Formula	C5H11NO2
Molecular Weight	117.1463
SMILES	O=C(O)CCCNC
Synonyms	4-(methylamino)butanoic acid, 4-(methylamino)butyric acid, gamma-N-methylaminobutyrate, 4-(Methylamino)butanoic acid, 1119-48-8, 4-(Methylamino)butyric acid, Butanoic acid, 4-(methylamino)-, 4-Methylaminobutyrate, CCRIS 1632, 4-methylaminobutyric acid, N-METHYL-4-AMINOBUTYRIC ACID, 4-Methylamino-buttersaeure, gamma-N-methylaminobutyrate, gamma-methylaminobutyric acid, 4-(N-methylamino)butyric acid, 4-(methyl amino)-Butanoic Acid, CHEBI:37755, AOKCDAVWJLOAHG-UHFFFAOYSA-N, N-Methyl-GABA, N-MeGABA, AC1Q5WCN, methyl-3-carboxypropylamine, AC1L2EO4, 4-(methylamino)-butyric acid, SCHEMBL288681, N-Methyl-|A-aminobutyric Acid, 4-(Methylamino)butanoic acid #, Butanoic acid,4-(methylamino)-, CHEMBL2074955, DTXSID9073250, CTK4A7585, ALBB-026447, ZINC1615390, 2115AA, MFCD00044627, STL300354, AKOS016010105, MCULE-7598762485, AJ-28281, AS-44843, SC-49793, AB0086238, DB-081956, LS-181809, 4CH-022111, FT-0671452, R1752, ST24043107, butanoic acid, 4-(methylamino)- hydrochloride, A21490, C15987, J-002673, C5H11NO2, N-Methyl-4-aminobutyric Acid-d3, C5-H11-N-O2, CID70703, AR-1G3563, 6976-17-6, 71901-46-7,

Complexity	72.8
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	117.079g/mol
Formal Charge	0
Heavy Atom Count	8
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	2
Isotope Atom Count	0
Molecular Weight	117.148g/mol
Monoisotopic Mass	117.079g/mol
Rotatable Bond Count	4
Topological Polar Surface Area	49.3A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	-2.6

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class	\N
Hazard statements	H315-H319-H335
Packing Group	\N
Precautionary statements	P261-P305+P351+P338
UN Code	\N

Certificate of Analysis

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