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85620-35-5

85620-35-5 | 2-Cyclopenten-1-one, 3,5-dimethyl-5-(1-methylethenyl)-

CAS No: 85620-35-5 Catalog No: AG005138 MDL No:

Product Description

Catalog Number:
AG005138
Chemical Name:
2-Cyclopenten-1-one, 3,5-dimethyl-5-(1-methylethenyl)-
CAS Number:
85620-35-5
Molecular Formula:
C10H14O
Molecular Weight:
150.2176
IUPAC Name:
3,5-dimethyl-5-prop-1-en-2-ylcyclopent-2-en-1-one
InChI:
InChI=1S/C10H14O/c1-7(2)10(4)6-8(3)5-9(10)11/h5H,1,6H2,2-4H3
InChI Key:
OIBTYPLMFAUNSO-UHFFFAOYSA-N
SMILES:
CC1=CC(=O)C(C1)(C)C(=C)C

Properties

Complexity:
248  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
150.104g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
150.221g/mol
Monoisotopic Mass:
150.104g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
17.1A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3  

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