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130927-57-0 | Anthracene, 1-bromo-9-[(2-methylphenyl)methyl]-
CAS No: 130927-57-0 Catalog No: AG000V47 MDL No:
Product Description
Catalog Number:
AG000V47
Chemical Name:
Anthracene, 1-bromo-9-[(2-methylphenyl)methyl]-
CAS Number:
130927-57-0
Molecular Formula:
C22H17Br
Molecular Weight:
361.2744
IUPAC Name:
1-bromo-9-[(2-methylphenyl)methyl]anthracene
InChI:
InChI=1S/C22H17Br/c1-15-7-2-3-8-16(15)14-20-19-11-5-4-9-17(19)13-18-10-6-12-21(23)22(18)20/h2-13H,14H2,1H3
InChI Key:
WKJVEFJLCBZKCR-UHFFFAOYSA-N
SMILES:
Cc1ccccc1Cc1c2ccccc2cc2c1c(Br)ccc2
Properties
Complexity:
391
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
360.051g/mol
Formal Charge:
0
Heavy Atom Count:
23
Hydrogen Bond Acceptor Count:
0
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
361.282g/mol
Monoisotopic Mass:
360.051g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
7.4
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