AG00AD38

1857-18-7 | N~1~,N~1~-dimethyl-beta-alaninamide

AG00AD38

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CAS Number	1857-18-7
Catalog Number	AG00AD38(AGN-PC-0N9IAU)
Chemical Name	N~1~,N~1~-dimethyl-beta-alaninamide
IUPAC Name	3-amino-N,N-dimethylpropanamide
InChI	InChI=1S/C5H12N2O/c1-7(2)5(8)3-4-6/h3-4,6H2,1-2H3
InChI Key	JNDIDJUNNCBHTI-UHFFFAOYSA-N
MDL Number	MFCD09736327
Molecular Formula	C5H12N2O
Molecular Weight	116.1616
SMILES	O=C(N(C)C)CCN
Synonyms	3-amino-N,N-dimethylpropanamide, 1857-18-7, 3-Amino-N,N-dimethyl-propionamide, AC1Q3VZ9, N,N-Dimethyl-beta-alaninamide, SCHEMBL960667, 3-amino-n,n-dimethylpropionamide, CTK0E2323, N1,N1-Dimethyl-beta-alaninamide, DTXSID60508673, JNDIDJUNNCBHTI-UHFFFAOYSA-N, ALBB-022639, MFCD09736327, Propanamide, 3-amino-N,N-dimethyl-, SBB085472, ZINC12481235, AKOS000144205, N~1~,N~1~-dimethyl-beta-alaninamide, MCULE-1852673058, AJ-62401, BS-12824, TR-057018, BB 0259500, CS-0051534, FT-0678809, X4955, EN300-50977, Y-5415, N~1~,N~1~-dimethyl-beta-alaninamide(SALTDATA, propanamide, 3-amino-N,N-dimethyl-, hydrochloride, J-011908, I14-30572, C5H12N2O, 3-Amino-N,N-dimethyl-propanamide HCl,

Complexity	80.5
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	116.095g/mol
Formal Charge	0
Heavy Atom Count	8
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	116.164g/mol
Monoisotopic Mass	116.095g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	46.3A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	-1.3

GHS Hazard and Precautionary Statements

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

Certificate of Analysis

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