AG00044W

1012884-46-6 | 1H-Dibenz[2,3:6,7]oxepino[4,5-c]pyrrol-1-one, 11-chloro-2,3-dihydro-2-methyl-

AG00044W

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CAS Number	1012884-46-6
Catalog Number	AG00044W(AGN-PC-0MXQR0)
Chemical Name	1H-Dibenz[2,3:6,7]oxepino[4,5-c]pyrrol-1-one, 11-chloro-2,3-dihydro-2-methyl-
IUPAC Name	17-chloro-4-methyl-13-oxa-4-azatetracyclo[12.4.0.02,6.07,12]octadeca-1(14),2(6),7,9,11,15,17-heptaen-3-one
InChI	InChI=1S/C17H12ClNO2/c1-19-9-13-11-4-2-3-5-14(11)21-15-7-6-10(18)8-12(15)16(13)17(19)20/h2-8H,9H2,1H3
InChI Key	KXKUDCTZEMWVDQ-UHFFFAOYSA-N
MDL Number	MFCD15145473
Molecular Formula	C17H12ClNO2
Molecular Weight	297.7357
SMILES	O=C1N(C)CC2=C1C3=CC(Cl)=CC=C3OC4=CC=CC=C42
Synonyms	1012884-46-6, 11-Chloro-2-methyl-2,3-dihydro-1H-dibenzo[2,3:6,7]oxepino[4,5-c]pyrrol-1-one, 11-Chloro-2,3-dihydro-2-methyl-1H-dibenz[2,3:6,7]oxepino[4,5-c]pyrrol-1-one, 1H-Dibenz[2,3:6,7]oxepino[4,5-c]pyrrol-1-one, 11-chloro-2,3-dihydro-2-methyl-, KXKUDCTZEMWVDQ-UHFFFAOYSA-N, SCHEMBL3152103, CTK8B9660, DTXSID20438689, BCP10013, CS-M0228, KS-00000Q6J, 0363AA, ANW-62855, MFCD15145473, ZINC34126533, AKOS016004062, AC-26427, AJ-87080, AK101594, AS-10031, DB-058588, TC-151600, FT-0701646, ST24038234, 11-Chloro-2-methyl-2,3-dihydro-1H-dibenzo[2,3, 884D466, 11 -chloro-2-methyl-2,3 -dihydro-1H-dibenzo [2,3:6,7]oxepino[4,5-c]pyrrol-1-one, 11-Chloro-2,3-dihydro-2-methyl-1H- dibenz[2,3:6,7]oxepino[4,5-c]pyrrol-1-one, 11-chloro-2-methyl-2,3-dihydro-1H-dibenzo [2,3:6,7] oxepino [4,5-c]pyrrol-1-one, 11-chloro-2-methyl-2,3-dihydro-1H-dibenzo [2,3:6,7]oxepino[4,5-c]pyrrol-1-one, C17H12ClNO2, CID10357298, CID 10357298, 5-Chloro-2-methyl-2,3-dihydrodibenzo[2,3:6,7]oxepino[4,5-c]pyrrole-(2H)-one, 934996-79-9,

Complexity	489
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	297.056g/mol
Formal Charge	0
Heavy Atom Count	21
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	297.738g/mol
Monoisotopic Mass	297.056g/mol
Rotatable Bond Count	0
Topological Polar Surface Area	29.5A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	2.9

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

Lot Number