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101166-81-8 | 1-Cyclooctene-1-carbonyl chloride
CAS No: 101166-81-8 Catalog No: AG0003VM MDL No:
Product Description
Catalog Number:
AG0003VM
Chemical Name:
1-Cyclooctene-1-carbonyl chloride
CAS Number:
101166-81-8
Molecular Formula:
C9H13ClO
Molecular Weight:
172.6519
IUPAC Name:
cyclooctene-1-carbonyl chloride
InChI:
InChI=1S/C9H13ClO/c10-9(11)8-6-4-2-1-3-5-7-8/h6H,1-5,7H2
InChI Key:
JFFBTNXIZZKUAW-UHFFFAOYSA-N
SMILES:
ClC(=O)C1=CCCCCCC1
Properties
Complexity:
172
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
172.065g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
172.652g/mol
Monoisotopic Mass:
172.065g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
17.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1
XLogP3:
3.8
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