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874504-11-7 | (E,Z)-1-Bromo-1,2-diphenyl-2-(4-hydroxyphenyl)ethene
CAS No: 874504-11-7 Catalog No: AG004FU8 MDL No:
Product Description
Catalog Number:
AG004FU8
Chemical Name:
(E,Z)-1-Bromo-1,2-diphenyl-2-(4-hydroxyphenyl)ethene
CAS Number:
874504-11-7
Molecular Formula:
C20H15BrO
Molecular Weight:
351.2365
IUPAC Name:
4-(2-bromo-1,2-diphenylethenyl)phenol
InChI:
InChI=1S/C20H15BrO/c21-20(17-9-5-2-6-10-17)19(15-7-3-1-4-8-15)16-11-13-18(22)14-12-16/h1-14,22H
InChI Key:
XUBABWJOIJRXNS-UHFFFAOYSA-N
SMILES:
Oc1ccc(cc1)C(=C(c1ccccc1)Br)c1ccccc1
Properties
Complexity:
369
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
350.031g/mol
Formal Charge:
0
Heavy Atom Count:
22
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
351.243g/mol
Monoisotopic Mass:
350.031g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
20.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1
XLogP3:
6.2
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