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201142-10-1 | Naphthalene, 6-bromo-4-(1,1-dimethylethyl)-1,2-dihydro-1,1-dimethyl-
CAS No: 201142-10-1 Catalog No: AG002D8K MDL No:
Product Description
Catalog Number:
AG002D8K
Chemical Name:
Naphthalene, 6-bromo-4-(1,1-dimethylethyl)-1,2-dihydro-1,1-dimethyl-
CAS Number:
201142-10-1
Molecular Formula:
C16H21Br
Molecular Weight:
293.2419
IUPAC Name:
6-bromo-4-tert-butyl-1,1-dimethyl-2H-naphthalene
InChI:
InChI=1S/C16H21Br/c1-15(2,3)13-8-9-16(4,5)14-7-6-11(17)10-12(13)14/h6-8,10H,9H2,1-5H3
InChI Key:
ZCSWMQGDLWJMPC-UHFFFAOYSA-N
SMILES:
Brc1ccc2c(c1)C(=CCC2(C)C)C(C)(C)C
Properties
Complexity:
319
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
292.083g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
0
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
293.248g/mol
Monoisotopic Mass:
292.083g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
5.8
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