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88070-28-4 | Cycloheptene, 3,6,6-trimethyl-
CAS No: 88070-28-4 Catalog No: AG004HWO MDL No:
Product Description
Catalog Number:
AG004HWO
Chemical Name:
Cycloheptene, 3,6,6-trimethyl-
CAS Number:
88070-28-4
Molecular Formula:
C10H18
Molecular Weight:
138.2499
IUPAC Name:
3,6,6-trimethylcycloheptene
InChI:
InChI=1S/C10H18/c1-9-5-4-7-10(2,3)8-6-9/h4-5,9H,6-8H2,1-3H3
InChI Key:
YCTPMOKNQNWVDT-UHFFFAOYSA-N
SMILES:
CC1C=CCC(CC1)(C)C
Properties
Complexity:
131
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
138.141g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
0
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
138.254g/mol
Monoisotopic Mass:
138.141g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
4
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