AG003SJG

2235-46-3 | N,N-Diethyl-3-oxobutanamide

AG003SJG

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CAS Number	2235-46-3
Catalog Number	AG003SJG(AGN-PC-0JKD1E)
Chemical Name	N,N-Diethyl-3-oxobutanamide
EC Number	218-792-3
IUPAC Name	N,N-diethyl-3-oxobutanamide
InChI	InChI=1S/C8H15NO2/c1-4-9(5-2)8(11)6-7(3)10/h4-6H2,1-3H3
InChI Key	NTMXFHGYWJIAAE-UHFFFAOYSA-N
MDL Number	MFCD00026728
Molecular Formula	C8H15NO2
Molecular Weight	157.2102
SMILES	O=C(C)CC(N(CC)CC)=O
UNII	LG9561531V
Synonyms	N,N-Diethylacetoacetamide, 2235-46-3, N,N-Diethyl-3-oxobutanamide, N,N-Diethyl-3-oxobutyramide, Diethylacetoacetamide, Butanamide, N,N-diethyl-3-oxo-, ACETOACETAMIDE, N,N-DIETHYL-, HSDB 2708, 1-(Diethylcarbamoyl)-2-propanone, N,N-Diethylacetylacetamide, Acetoacetdiethylamide, Diethylamid kyseliny acetoctove, UNII-LG9561531V, EINECS 218-792-3, Diethylamid kyseliny acetoctove [Czech], BRN 0636486, AI3-06569, NTMXFHGYWJIAAE-UHFFFAOYSA-N, MFCD00026728, LG9561531V, DEAA, ACMC-1CMBJ, N-Acetoacetyldiethylamine, EC 218-792-3, 3-oxo-N,N-diethylbutyramide, SCHEMBL56983, N,N Diethyl-3-oxobutyramide, N,N-diethyl-3-oxo-butanamide, AC1L28I6, Butanamide,N,N-diethyl-3-oxo-, DTXSID8052695, N,N-Diethyl-3-oxobutanamide #, CTK4E9255, ZINC2038766, ANW-24842, SBB042488, STL264118, AKOS000120470, MCULE-9697121939, NE10874, VZ36408, KS-00000X13, AN-50588, CJ-32172, LS-13034, S732, SC-50973, DB-045878, TC-113587, FT-0629465, ST50409581, W-109764, I14-90950, F0001-0789, N,N-Diethylacetoacetamide, Lonza quality, 98.0-100.3% (w/w) (T), C8H15NO2, C8-H15-N-O2, CID16699, D1371, 4-04-00-00409 (Beilstein Handbook Reference),

Complexity	150
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	157.11g/mol
Formal Charge	0
Heavy Atom Count	11
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	157.213g/mol
Monoisotopic Mass	157.11g/mol
Rotatable Bond Count	4
Topological Polar Surface Area	37.4A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	0.3

GHS Hazard and Precautionary Statements

Symbol:
Hazard statements	H317-H319
Precuationary statements	P280-P305+P351+P338
Siginal words

Certificate of Analysis

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