3-Bromo-N-phenylcarbazole - CAS 1153-85-1

Catalog:	BB043907
Product Name:	3-Bromo-N-phenylcarbazole
CAS:	1153-85-1
Synonyms:	3-Bromo-9-phenylcarbazole; 3-bromo-9-phenyl-9H-carbazole; 3-Bromo-N-phenylcarbazole; 3-bromo-N-phenyl-9H-carbazole

Technical Data

Safety and Hazards

Computed Properties

IUPAC Name:	3-bromo-9-phenylcarbazole
Description:	3-Bromo-N-phenylcarbazole (CAS# 1153-85-1 ) is a useful research chemical.
Molecular Weight:	322.20
Molecular Formula:	C18H12BrN
Canonical SMILES:	C1=CC=C(C=C1)N2C3=C(C=C(C=C3)Br)C4=CC=CC=C42
InChI:	InChI=1S/C18H12BrN/c19-13-10-11-18-16(12-13)15-8-4-5-9-17(15)20(18)14-6-2-1-3-7-14/h1-12H
InChI Key:	KUBSCXXKQGDPPD-UHFFFAOYSA-N
Boiling Point:	461.7 ± 27.0 °C (predicted)
Purity:	99 %
Density:	1.39 g/cm³
Appearance:	White powder

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Related Functional Groups

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[1208005-83-7]
Bis(9,9-dimethyl-9H-fluoren-2-yl)diphenylsilane

Halides

[134005-20-2]
(Z)-1,3-Diiodo-2-butene
[333311-69-6]
1-(4-Bromobenzyl)-3,5-dimethyl-4-nitro-1H-pyrazole
[51355-91-0]
1-(Chloromethyl)-3,5-dimethyl-4-nitro-1H-pyrazole
[102388-00-1]
1-(Chloromethyl)-3-nitro-1H-pyrazole
[4860-03-1]
1-Chlorohexadecane
[111-85-3]
1-Chlorooctane

GHS Hazard Statement:	H302 (50%): Harmful if swallowed [Warning Acute toxicity, oral]; H312 (50%): Harmful in contact with skin [Warning Acute toxicity, dermal]; H315 (50%): Causes skin irritation [Warning Skin corrosion/irritation]; H319 (50%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]; H332 (50%): Harmful if inhaled [Warning Acute toxicity, inhalation]
Precautionary Statement:	P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P317, P321, P330, P332+P317, P337+P317, P362+P364, and P501
Signal Word:	Warning

Complexity:	338
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	321.01531
Formal Charge:	0
Heavy Atom Count:	20
Hydrogen Bond Acceptor Count:	0
Hydrogen Bond Donor Count:	0
Isotope Atom Count:	0
Monoisotopic Mass:	321.01531
Rotatable Bond Count:	1
Topological Polar Surface Area:	4.9
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	5.7