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7045-69-4 | Cyclohexane, 1,2-bis(1-methylethyl)-
CAS No: 7045-69-4 Catalog No: AG005IW5 MDL No:
Product Description
Catalog Number:
AG005IW5
Chemical Name:
Cyclohexane, 1,2-bis(1-methylethyl)-
CAS Number:
7045-69-4
Molecular Formula:
C12H24
Molecular Weight:
168.3190
IUPAC Name:
1,2-di(propan-2-yl)cyclohexane
InChI:
InChI=1S/C12H24/c1-9(2)11-7-5-6-8-12(11)10(3)4/h9-12H,5-8H2,1-4H3
InChI Key:
IVHLZTLSMDNSTG-UHFFFAOYSA-N
SMILES:
CC(C1CCCCC1C(C)C)C
Properties
Complexity:
108
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
168.188g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
0
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
168.324g/mol
Monoisotopic Mass:
168.188g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
5.3
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