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19118-19-5

19118-19-5 | Ethanamine, 2-[4-[(1E)-2-bromo-1,2-diphenylethenyl]phenoxy]-N,N-dimethyl-

CAS No: 19118-19-5 Catalog No: AG002F3E MDL No:

Product Description

Catalog Number:
AG002F3E
Chemical Name:
Ethanamine, 2-[4-[(1E)-2-bromo-1,2-diphenylethenyl]phenoxy]-N,N-dimethyl-
CAS Number:
19118-19-5
Molecular Formula:
C24H24BrNO
Molecular Weight:
422.3575
IUPAC Name:
2-[4-[(E)-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/b24-23+
InChI Key:
IAJYQHATSIOBSH-WCWDXBQESA-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:
1  
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:
0
XLogP3:
6.6  

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