AG002CWL

200698-05-1 | 9H-Carbazole-3,6-dicarboxaldehyde, 9-(phenylmethyl)-

AG002CWL

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CAS Number	200698-05-1
Catalog Number	AG002CWL(AGN-PC-022S6Y)
Chemical Name	9H-Carbazole-3,6-dicarboxaldehyde, 9-(phenylmethyl)-
IUPAC Name	9-benzylcarbazole-3,6-dicarbaldehyde
InChI	InChI=1S/C21H15NO2/c23-13-16-6-8-20-18(10-16)19-11-17(14-24)7-9-21(19)22(20)12-15-4-2-1-3-5-15/h1-11,13-14H,12H2
InChI Key	RZSXZJXJVWYRIU-UHFFFAOYSA-N
MDL Number	MFCD08276316
Molecular Formula	C21H15NO2
Molecular Weight	313.3493
SMILES	O=CC1=CC2=C(C=C1)N(CC3=CC=CC=C3)C4=C2C=C(C=O)C=C4
Synonyms	200698-05-1, 9-Benzylcarbazole-3,6-dicarboxaldehyde, 9-benzyl-9H-carbazole-3,6-dicarbaldehyde, ACMC-1CQ99, SCHEMBL689732, 3,6-diformyl-9-benzylcarbazole, 9-Benzyl-3,6-diformylcarbazole, CTK4E3208, DTXSID70596607, RZSXZJXJVWYRIU-UHFFFAOYSA-N, KS-000016CM, ANW-23908, MFCD08276316, ZINC44069368, AKOS015839185, TRA0032071, VZ31111, CC-23520, DB-045077, TR-009348, 9-BENZYLCARBAZOLE-3,6-DICARBALDEHYDE, B2805, FT-0643872, C-19358, 9H-Carbazole-3,6-dicarboxaldehyde,9-(phenylmethyl)-,

Complexity	427
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	313.11g/mol
Formal Charge	0
Heavy Atom Count	24
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	313.356g/mol
Monoisotopic Mass	313.11g/mol
Rotatable Bond Count	4
Topological Polar Surface Area	39.1A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	3.9

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class	\N
Hazard statements	H315-H319
Packing Group	\N
Precautionary statements	P264-P280-P302+P352+P332+P313+P362+P364-P305+P351+P338+P337+P313
UN Code	\N

Certificate of Analysis

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