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Home > Other Heterocycles > 1935254-69-5
1935254-69-5 | 6,6-dimethylbicyclo[3.1.1]heptane-2-sulfonyl chloride
CAS No: 1935254-69-5 Catalog No: AG01BM50 MDL No:MFCD31426438
Product Description
Catalog Number:
AG01BM50
Chemical Name:
6,6-dimethylbicyclo[3.1.1]heptane-2-sulfonyl chloride
CAS Number:
1935254-69-5
Molecular Formula:
C9H15ClO2S
Molecular Weight:
222.7322
MDL Number:
MFCD31426438
IUPAC Name:
6,6-dimethylbicyclo[3.1.1]heptane-2-sulfonyl chloride
InChI:
InChI=1S/C9H15ClO2S/c1-9(2)6-3-4-8(7(9)5-6)13(10,11)12/h6-8H,3-5H2,1-2H3
InChI Key:
YZVUYPLNFAMNDQ-UHFFFAOYSA-N
SMILES:
ClS(=O)(=O)C1CCC2CC1C2(C)C
Properties
Complexity:
315
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
222.048g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
222.727g/mol
Monoisotopic Mass:
222.048g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
42.5A^2
Undefined Atom Stereocenter Count:
3
Undefined Bond Stereocenter Count:
0
XLogP3:
2.8
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