2-Bromobenzo[9,10]phenanthrene

C₁₈H₁₁BrCAS 19111-87-6307.19 g/mol

Open in Covalent MOL file

Properties

Molecular formula: C₁₈H₁₁Br
Molar mass: 307.19 g/mol
Exact mass: 306.0044 Da
logP: 5.91Crippen estimate
Polar surface area: 0.0 Å²
H-bond donors / acceptors: 0 / 0
Rotatable bonds: 0

Hazards

Warning

H315 Causes skin irritation100% of notifiers
H319 Causes serious eye irritation100% of notifiers

Aggregated from 2 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P264, P264+P265, P280, P302+P352, P305+P351+P338, P321, P332+P317, P337+P317, P362+P364

Identifiers

CAS number

19111-87-6

SMILES

C1=CC=C2C(=C1)C3=C(C=C(C=C3)Br)C4=CC=CC=C24

InChIKey

GEDOYYDMCZUHNW-UHFFFAOYSA-N

InChI

InChI=1S/C18H11Br/c19-12-9-10-17-15-7-2-1-5-13(15)14-6-3-4-8-16(14)18(17)11-12/h1-11H

Weigh it out

Type any one amount. The others follow from the molar mass.

Names and synonyms

1 names

2-Bromotriphenylene

Work with 2-Bromobenzo[9,10]phenanthrene

Predict the NMR spectrum1H and 13C shifts with multiplicities Make a solutionWhat to weigh for any molarity and volume Check drug-likenessLipinski, Veber and lead-likeness Isotope patternExact mass and the mass spectrum pattern

Similar compounds

2,7-Dibromotriphenylene888041-37-0100 % similar 3-Bromophenanthrene715-50-463 % similar 2-(3-Bromophenyl)triphenylene1313514-53-262 % similar 2-Bromo-9,10-diphenylanthracene201731-79-562 % similar 2-Bromophenanthrene62162-97-460 % similar 2,8-Dibromoindeno[1,2-b]fluorene-6,12-dione853234-57-860 % similar 3-Bromocarbazole1592-95-656 % similar 2-Bromodibenzothiophene22439-61-856 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds

Same formula

4-Bromobenzo[A]anthracene61921-39-9

Elsewhere

PubChem CAS Common Chemistry NIST WebBook