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27802-85-3 | Nonane, 3,4,7-trimethyl-
CAS No: 27802-85-3 Catalog No: AG002USN MDL No:
Product Description
Catalog Number:
AG002USN
Chemical Name:
Nonane, 3,4,7-trimethyl-
CAS Number:
27802-85-3
Molecular Formula:
C12H26
Molecular Weight:
170.3348
IUPAC Name:
3,4,7-trimethylnonane
InChI:
InChI=1S/C12H26/c1-6-10(3)8-9-12(5)11(4)7-2/h10-12H,6-9H2,1-5H3
InChI Key:
HQIBDLHPQGDJEW-UHFFFAOYSA-N
SMILES:
CCC(CCC(C(CC)C)C)C
Properties
Complexity:
96.2
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
170.203g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
0
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
170.34g/mol
Monoisotopic Mass:
170.203g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
3
Undefined Bond Stereocenter Count:
0
XLogP3:
5.8
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