AG000C86

116332-64-0 | Benzamide, 4-cyano-N-methoxy-N-methyl-

AG000C86

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CAS Number	116332-64-0
Catalog Number	AG000C86(AGN-PC-0NEJK5)
Chemical Name	Benzamide, 4-cyano-N-methoxy-N-methyl-
IUPAC Name	4-cyano-N-methoxy-N-methylbenzamide
InChI	InChI=1S/C10H10N2O2/c1-12(14-2)10(13)9-5-3-8(7-11)4-6-9/h3-6H,1-2H3
InChI Key	BZGBXNBROBZKLC-UHFFFAOYSA-N
MDL Number	MFCD07367975
Molecular Formula	C10H10N2O2
Molecular Weight	190.1986
SMILES	O=C(C1=CC=C(C#N)C=C1)N(OC)C
Synonyms	4-Cyano-N-methoxy-N-methylbenzamide, 116332-64-0, 4-Cyano-N-methoxy-N-methylbenzenecarboxamide, Benzamide,4-cyano-N-methoxy-N-methyl-, Benzamide, 4-cyano-N-methoxy-N-methyl-, ACMC-1BU41, SCHEMBL286133, CTK4A9745, DTXSID80452104, BZGBXNBROBZKLC-UHFFFAOYSA-N, cyanomethoxymethylbenzenecarboxamide, ZINC8730059, N-Methoxy-N-methyl-4-cyanobenzamide, 9728AC, MFCD07367975, SBB091119, AKOS005072967, AB31533, AS05889, CM13170, HA-0842, MCULE-5860399859, RP11259, RTR-003011, KS-00000O38, 4-[Methoxy(methyl)carbamoyl]benzonitrile, AC-14385, AK305547, TR-003011, (4-Cyanophenyl)-N-methoxy-N-methylformamide, FT-0681092, (4-cyanophenyl)-N-methoxy-N-methylcarboxamide, Z-1719, J-515231, I01-13055, F1903-0219, C10H10N2O2, 4-cyano-N-methoxy-N-methyl-benzamide, CID11019640,

Complexity	248
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	190.074g/mol
Formal Charge	0
Heavy Atom Count	14
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	190.202g/mol
Monoisotopic Mass	190.074g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	53.3A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.1

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302
Packing Group
Precautionary statements	P280-P305+P351+P338
UN Code

Certificate of Analysis

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