AG00DG22

52598-02-4 | 5-Chloro-2,3-diphenyl-1H-indole

AG00DG22

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CAS Number	52598-02-4
Catalog Number	AG00DG22(AGN-PC-0JNRM3)
Chemical Name	5-Chloro-2,3-diphenyl-1H-indole
IUPAC Name	5-chloro-2,3-diphenyl-1H-indole
InChI	InChI=1S/C20H14ClN/c21-16-11-12-18-17(13-16)19(14-7-3-1-4-8-14)20(22-18)15-9-5-2-6-10-15/h1-13,22H
InChI Key	BAEWCDBRAIDXMN-UHFFFAOYSA-N
MDL Number	MFCD00974243
Molecular Formula	C20H14ClN
Molecular Weight	303.7849
NSC Number	76682
SMILES	ClC1=CC2=C(NC(C3=CC=CC=C3)=C2C4=CC=CC=C4)C=C1
Synonyms	5-chloro-2,3-diphenyl-1h-indole, 52598-02-4, NSC76682, AC1L5OFB, AC1Q3MRS, SCHEMBL7039216, CTK4J6154, KS-00000OPL, DTXSID10291588, BAEWCDBRAIDXMN-UHFFFAOYSA-N, 2,3-Diphenyl-5-chloro-1H-indole, ZINC4887445, ANW-61284, EBD167492, MFCD00974243, NSC-76682, AKOS005095946, MCULE-4006337701, AC-26897, AJ-52511, AK-49855, AX8212406, TC-150029, FT-0687579, X4208, 6K-911, A21370, C20H14ClN, AR-1G7697, CID253583, ACN-036121, 56330-88-2,

Complexity	359
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	303.081g/mol
Formal Charge	0
Heavy Atom Count	22
Hydrogen Bond Acceptor Count	0
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	303.789g/mol
Monoisotopic Mass	303.081g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	15.8A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	6

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

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