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19076-79-0 | Ethanamine, 2-[4-(2-bromo-1,2-diphenylethenyl)phenoxy]-N,N-dimethyl-
CAS No: 19076-79-0 Catalog No: AG002ERP MDL No:
Product Description
Catalog Number:
AG002ERP
Chemical Name:
Ethanamine, 2-[4-(2-bromo-1,2-diphenylethenyl)phenoxy]-N,N-dimethyl-
CAS Number:
19076-79-0
Molecular Formula:
C24H24BrNO
Molecular Weight:
422.3575
IUPAC Name:
2-[4-(2-bromo-1,2-diphenylethenyl)phenoxy]-N,N-dimethylethanamine
InChI:
InChI=1S/C24H24BrNO/c1-26(2)17-18-27-22-15-13-20(14-16-22)23(19-9-5-3-6-10-19)24(25)21-11-7-4-8-12-21/h3-16H,17-18H2,1-2H3
InChI Key:
IAJYQHATSIOBSH-UHFFFAOYSA-N
SMILES:
CN(CCOc1ccc(cc1)C(=C(c1ccccc1)Br)c1ccccc1)C
Properties
Complexity:
455
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
421.104g/mol
Formal Charge:
0
Heavy Atom Count:
27
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
422.366g/mol
Monoisotopic Mass:
421.104g/mol
Rotatable Bond Count:
7
Topological Polar Surface Area:
12.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1
XLogP3:
6.6
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