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Home > Other Heterocycles > 95685-43-1
95685-43-1 | Bicyclo[3.2.1]octane-3-carbonylchloride, 3-(1-methylethyl)-
CAS No: 95685-43-1 Catalog No: AG005Z0G MDL No:
Product Description
Catalog Number:
AG005Z0G
Chemical Name:
Bicyclo[3.2.1]octane-3-carbonylchloride, 3-(1-methylethyl)-
CAS Number:
95685-43-1
Molecular Formula:
C12H19ClO
Molecular Weight:
214.7317
IUPAC Name:
3-propan-2-ylbicyclo[3.2.1]octane-3-carbonyl chloride
InChI:
InChI=1S/C12H19ClO/c1-8(2)12(11(13)14)6-9-3-4-10(5-9)7-12/h8-10H,3-7H2,1-2H3
InChI Key:
LTOUQLYYCBCTIC-UHFFFAOYSA-N
SMILES:
CC(C1(CC2CCC(C1)C2)C(=O)Cl)C
Properties
Complexity:
235
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:
2
Topological Polar Surface Area:
17.1A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
4.3
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