AG00IAAN

57834-33-0 | Benzoic acid, 4-[[(methylphenylamino)methylene]amino]-, ethyl ester

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CAS Number	57834-33-0
Catalog Number	AG00IAAN(AGN-PC-0JM0CY)
Chemical Name	Benzoic acid, 4-[[(methylphenylamino)methylene]amino]-, ethyl ester
EC Number	260-976-0
IUPAC Name	ethyl 4-[(N-methylanilino)methylideneamino]benzoate
InChI	InChI=1S/C17H18N2O2/c1-3-21-17(20)14-9-11-15(12-10-14)18-13-19(2)16-7-5-4-6-8-16/h4-13H,3H2,1-2H3
InChI Key	GNGYPJUKIKDJQT-UHFFFAOYSA-N
MDL Number	MFCD09263624
Molecular Formula	C17H18N2O2
Molecular Weight	282.3370
SMILES	O=C(OCC)C1=CC=C(/N=C/N(C)C2=CC=CC=C2)C=C1
Synonyms	57834-33-0, Ethyl 4-[[(methylphenylamino)methylene]amino]benzoate, Ethyl 4-(((methyl(phenyl)amino)methylene)amino)benzoate, Benzoic acid, 4-[[(methylphenylamino)methylene]amino]-, ethyl ester, Ethyl 4-(((methylphenylamino)methylene)amino)benzoate, (E)-Ethyl 4-[[(Methylphenylamino)Methylene]Amino]Benzoate, Benzoic acid, 4-(((methylphenylamino)methylene)amino)-, ethyl ester, Benzoic acid,4-[[(methylphenylamino)methylene]amino]-, ethyl ester, ethyl 4-{[(methylphenylamino)methylene]amino}benzoate, EINECS 260-976-0, AC1L3QYH, AC1Q64SU, KSC607K1J, SCHEMBL454046, SCHEMBL536866, DTXSID5069207, CTK5A7514, KS-00000SVP, ZINC5139818, KM0149, MFCD09263624, AKOS015895821, AKOS028108590, ZINC242495710, DS-9457, AK167262, AN-39865, CC-27968, CJ-12463, FT-0640490, TL80090890, 834E330, C-28067, ethyl 4-[(N-methylanilino)methyleneamino]benzoate, ethyl 4-[(N-methylanilino)methylideneamino]benzoate, I06-1452, (E)-ethyl 4-((methyl(phenyl)amino)methyleneamino)benzoate, 4-[[(Methylphenylamino)methylene]amino]benzoic acid ethyl ester, UV-1, C17H18N2O2, ACN-S002301, CID93817, AR-1I8925, C17-H18-N2-O2, N-(Ethoxycarbonylphenyl)-N'-methyl-N'-phenyl formamidine, N-(Ethoxycarbonylphenyl)-N'-Methyl-N'-Phenylformamidine, 59578-11-9,

Complexity	343
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	282.137g/mol
Formal Charge	0
Heavy Atom Count	21
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	282.343g/mol
Monoisotopic Mass	282.137g/mol
Rotatable Bond Count	6
Topological Polar Surface Area	41.9A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	3.4

GHS Hazard and Precautionary Statements

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

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