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139300-27-9 | Naphthalene, 1-(2-bromoethyl)-7-methyl-
CAS No: 139300-27-9 Catalog No: AG001APF MDL No:
Product Description
Catalog Number:
AG001APF
Chemical Name:
Naphthalene, 1-(2-bromoethyl)-7-methyl-
CAS Number:
139300-27-9
Molecular Formula:
C13H13Br
Molecular Weight:
249.1463
IUPAC Name:
1-(2-bromoethyl)-7-methylnaphthalene
InChI:
InChI=1S/C13H13Br/c1-10-5-6-11-3-2-4-12(7-8-14)13(11)9-10/h2-6,9H,7-8H2,1H3
InChI Key:
CWHTYTITDRCILG-UHFFFAOYSA-N
SMILES:
BrCCc1cccc2c1cc(C)cc2
Properties
Complexity:
178
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
248.02g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
0
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
249.151g/mol
Monoisotopic Mass:
248.02g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
5.1
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