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10275-58-8 | Naphthalene, 2,7-bis(1,1-dimethylethyl)-
CAS No: 10275-58-8 Catalog No: AG0008AL MDL No:MFCD00094397
Product Description
Catalog Number:
AG0008AL
Chemical Name:
Naphthalene, 2,7-bis(1,1-dimethylethyl)-
CAS Number:
10275-58-8
Molecular Formula:
C18H24
Molecular Weight:
240.3832
MDL Number:
MFCD00094397
IUPAC Name:
2,7-ditert-butylnaphthalene
InChI:
InChI=1S/C18H24/c1-17(2,3)15-9-7-13-8-10-16(18(4,5)6)12-14(13)11-15/h7-12H,1-6H3
InChI Key:
IHRUNSCACKKOPP-UHFFFAOYSA-N
SMILES:
CC(c1ccc2c(c1)cc(cc2)C(C)(C)C)(C)C
Properties
Complexity:
247
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
240.188g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
0
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
240.39g/mol
Monoisotopic Mass:
240.188g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
6.9
Literature
| Title | Journal |
|---|---|
| 3-tert-Butyl-5,6,8-trinitro-naphtho[1,8a,8-cd][1,2]dithiole. | Acta crystallographica. Section E, Structure reports online 20080501 |
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