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113714-57-1 | Nonadecane, 3,7-dimethyl-
CAS No: 113714-57-1 Catalog No: AG0009FO MDL No:
Product Description
Catalog Number:
AG0009FO
Chemical Name:
Nonadecane, 3,7-dimethyl-
CAS Number:
113714-57-1
Molecular Formula:
C21H44
Molecular Weight:
296.5741
IUPAC Name:
3,7-dimethylnonadecane
InChI:
InChI=1S/C21H44/c1-5-7-8-9-10-11-12-13-14-15-17-21(4)19-16-18-20(3)6-2/h20-21H,5-19H2,1-4H3
InChI Key:
ZRWWZZPRTCSWHU-UHFFFAOYSA-N
SMILES:
CCCCCCCCCCCCC(CCCC(CC)C)C
Properties
Complexity:
185
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
296.344g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
0
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
296.583g/mol
Monoisotopic Mass:
296.344g/mol
Rotatable Bond Count:
16
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
11
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