AG007673

118599-27-2 | 9H-Carbazole, 3,6-dibromo-9-(phenylmethyl)-

AG007673

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CAS Number	118599-27-2
Catalog Number	AG007673(AGN-PC-0KLC5D)
Chemical Name	9H-Carbazole, 3,6-dibromo-9-(phenylmethyl)-
IUPAC Name	9-benzyl-3,6-dibromocarbazole
InChI	InChI=1S/C19H13Br2N/c20-14-6-8-18-16(10-14)17-11-15(21)7-9-19(17)22(18)12-13-4-2-1-3-5-13/h1-11H,12H2
InChI Key	QVFWRFBJSIUPAD-UHFFFAOYSA-N
MDL Number	MFCD00218292
Molecular Formula	C19H13Br2N
Molecular Weight	415.1212
SMILES	BrC1=CC2=C(N(CC3=CC=CC=C3)C4=C2C=C(Br)C=C4)C=C1
Synonyms	9-benzyl-3,6-dibromocarbazole, 118599-27-2, 3,6-Dibromo-9-benzyl-9H-carbazole, N-benzyl-3,6-dibromocarbazole, 9H-Carbazole, 3,6-dibromo-9-(phenylmethyl)-, ACMC-20mnwg, AC1MCWN3, SCHEMBL2244878, CTK0F9822, DTXSID00384337, QVFWRFBJSIUPAD-UHFFFAOYSA-N, KS-00000TB4, ZINC3128809, 9-benzyl-3,6-dibromo-9H-carbazole, MFCD00218292, AKOS026671313, MCULE-2410558026, AK192606, DS-10059, B4348, 9-benzyl-3,6-dibromo-carbazole, CID2802035,

Complexity	356
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	414.939g/mol
Formal Charge	0
Heavy Atom Count	22
Hydrogen Bond Acceptor Count	0
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	415.128g/mol
Monoisotopic Mass	412.941g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	4.9A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	6.3

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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