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89272-30-0 | 4-Nonen-2-one, 4,6,6,8,8-pentamethyl-
CAS No: 89272-30-0 Catalog No: AG0041BX MDL No:
Product Description
Catalog Number:
AG0041BX
Chemical Name:
4-Nonen-2-one, 4,6,6,8,8-pentamethyl-
CAS Number:
89272-30-0
Molecular Formula:
C14H26O
Molecular Weight:
210.3556
IUPAC Name:
4,6,6,8,8-pentamethylnon-4-en-2-one
InChI:
InChI=1S/C14H26O/c1-11(8-12(2)15)9-14(6,7)10-13(3,4)5/h9H,8,10H2,1-7H3
InChI Key:
FCVJOJNBYRPXTE-UHFFFAOYSA-N
SMILES:
CC(=O)CC(=CC(CC(C)(C)C)(C)C)C
Properties
Complexity:
251
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
210.198g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
210.361g/mol
Monoisotopic Mass:
210.198g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
17.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1
XLogP3:
4.6
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