AG0033TN

6976-17-6 | 4-(Methylamino)-Butanoic Acid Hydrochloride

AG0033TN

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CAS Number	6976-17-6
Catalog Number	AG0033TN(AGN-PC-0NJNXY)
Chemical Name	4-(Methylamino)-Butanoic Acid Hydrochloride
IUPAC Name	4-(methylamino)butanoic acid;hydrochloride
InChI	InChI=1S/C5H11NO2.ClH/c1-6-4-2-3-5(7)8;/h6H,2-4H2,1H3,(H,7,8);1H
InChI Key	JMLHQRQZCMCQNJ-UHFFFAOYSA-N
MDL Number	MFCD00012612
Molecular Formula	C5H12ClNO2
Molecular Weight	153.6073
NSC Number	24931
SMILES	Cl.CNCCCC(=O)O
Synonyms	6976-17-6, 4-(Methylamino)butyric acid hydrochloride, 4-(Methylamino)butanoic acid hydrochloride, 4-(Methylamino)-Butanoic Acid Hydrochloride, ACMC-20amuc, 4-(METHYLAMINO)BUTANOIC ACID HCL, SCHEMBL380897, CTK8C5909, DTXSID90504845, JMLHQRQZCMCQNJ-UHFFFAOYSA-N, 4-(methylamino) butyric acid HCl, NSC24931, 5494AH, MFCD00012612, NSC-24931, AKOS008030625, 4-(methylamino)butanoic acid, chloride, ACN-033772, DS-9452, MCULE-7877286915, NE39657, SB01006, 4-(methylamino)butanoicacidhydrochloride, 4-Methylamino-butyric acid hydrochloride, AK151297, DB-055341, TC-169275, FT-0636327, ST51038104, 4-(Methylamino)butyric acid hydrochloride, 99%, Butanoic acid,4-(methylamino)-,hydrochloride(1:1), I04-9440, 4-(Methylamino)butanoic acid--hydrogen chloride (1/1), C5H11NO2.HCl,

Complexity	72.8
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	2
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	153.056g/mol
Formal Charge	0
Heavy Atom Count	9
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	3
Isotope Atom Count	0
Molecular Weight	153.606g/mol
Monoisotopic Mass	153.056g/mol
Rotatable Bond Count	4
Topological Polar Surface Area	49.3A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0

GHS Hazard and Precautionary Statements

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

Certificate of Analysis

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