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Home > Other Heterocycles > 95070-39-6
95070-39-6 | Spiro[4.6]undecane-2-carbonylchloride
CAS No: 95070-39-6 Catalog No: AG005TFL MDL No:MFCD13173466
Product Description
Catalog Number:
AG005TFL
Chemical Name:
Spiro[4.6]undecane-2-carbonylchloride
CAS Number:
95070-39-6
Molecular Formula:
C12H19ClO
Molecular Weight:
214.7317
MDL Number:
MFCD13173466
IUPAC Name:
spiro[4.6]undecane-3-carbonyl chloride
InChI:
InChI=1S/C12H19ClO/c13-11(14)10-5-8-12(9-10)6-3-1-2-4-7-12/h10H,1-9H2
InChI Key:
HZGJMMJPEYTLBW-UHFFFAOYSA-N
SMILES:
ClC(=O)C1CCC2(C1)CCCCCC2
Properties
Complexity:
216
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
214.112g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
214.733g/mol
Monoisotopic Mass:
214.112g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
17.1A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
4.9
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