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4390-04-9 | 2,2,4,4,6,8,8-Heptamethylnonane
CAS No: 4390-04-9 Catalog No: AG003B2Z MDL No:MFCD00008856
Product Description
Catalog Number:
AG003B2Z
Chemical Name:
2,2,4,4,6,8,8-Heptamethylnonane
CAS Number:
4390-04-9
Molecular Formula:
C16H34
Molecular Weight:
226.4412
MDL Number:
MFCD00008856
IUPAC Name:
2,2,4,4,6,8,8-heptamethylnonane
InChI:
InChI=1S/C16H34/c1-13(10-14(2,3)4)11-16(8,9)12-15(5,6)7/h13H,10-12H2,1-9H3
InChI Key:
VCLJODPNBNEBKW-UHFFFAOYSA-N
SMILES:
CC(CC(CC(C)(C)C)(C)C)CC(C)(C)C
EC Number:
224-506-8
NSC Number:
77129
Properties
Complexity:
197
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
226.266g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
0
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
226.448g/mol
Monoisotopic Mass:
226.266g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
7.3
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