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1453-25-4 | Cycloheptene, 1-methyl-
CAS No: 1453-25-4 Catalog No: AG001KRX MDL No:MFCD00021675
Product Description
Catalog Number:
AG001KRX
Chemical Name:
Cycloheptene, 1-methyl-
CAS Number:
1453-25-4
Molecular Formula:
C8H14
Molecular Weight:
110.1968
MDL Number:
MFCD00021675
IUPAC Name:
1-methylcycloheptene
InChI:
InChI=1S/C8H14/c1-8-6-4-2-3-5-7-8/h6H,2-5,7H2,1H3
InChI Key:
MREBNFRVGNTYOV-UHFFFAOYSA-N
SMILES:
CC1=CCCCCC1
EC Number:
215-923-6
Properties
Complexity:
90.2
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
110.11g/mol
Formal Charge:
0
Heavy Atom Count:
8
Hydrogen Bond Acceptor Count:
0
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
110.2g/mol
Monoisotopic Mass:
110.11g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.9
Literature
| Title | Journal |
|---|---|
| Secondary organic aerosol formation from the ozonolysis of cycloalkenes and related compounds. | Environmental science & technology 20040801 |
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