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113768-25-5 | 1,3-Cyclohexadiene, 1-methyl-4-propyl-
CAS No: 113768-25-5 Catalog No: AG0009LZ MDL No:
Product Description
Catalog Number:
AG0009LZ
Chemical Name:
1,3-Cyclohexadiene, 1-methyl-4-propyl-
CAS Number:
113768-25-5
Molecular Formula:
C10H16
Molecular Weight:
136.2340
IUPAC Name:
1-methyl-4-propylcyclohexa-1,3-diene
InChI:
InChI=1S/C10H16/c1-3-4-10-7-5-9(2)6-8-10/h5,7H,3-4,6,8H2,1-2H3
InChI Key:
QDSVHUIXOBBMCW-UHFFFAOYSA-N
SMILES:
CCCC1=CC=C(CC1)C
Properties
Complexity:
161
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
136.125g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
0
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
136.238g/mol
Monoisotopic Mass:
136.125g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3
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