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123630-38-6 | 1-Naphthalenol, 2-bromo-3,4-bis(phenylmethyl)-
CAS No: 123630-38-6 Catalog No: AG000KW8 MDL No:
Product Description
Catalog Number:
AG000KW8
Chemical Name:
1-Naphthalenol, 2-bromo-3,4-bis(phenylmethyl)-
CAS Number:
123630-38-6
Molecular Formula:
C24H19BrO
Molecular Weight:
403.3111
IUPAC Name:
3,4-dibenzyl-2-bromonaphthalen-1-ol
InChI:
InChI=1S/C24H19BrO/c25-23-22(16-18-11-5-2-6-12-18)21(15-17-9-3-1-4-10-17)19-13-7-8-14-20(19)24(23)26/h1-14,26H,15-16H2
InChI Key:
CWZHJPUIKUUFGB-UHFFFAOYSA-N
SMILES:
Oc1c(Br)c(Cc2ccccc2)c(c2c1cccc2)Cc1ccccc1
Properties
Complexity:
426
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
402.062g/mol
Formal Charge:
0
Heavy Atom Count:
26
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
403.319g/mol
Monoisotopic Mass:
402.062g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
20.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
7.4
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