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Home > Other Heterocycles > 753454-46-5
753454-46-5 | 2-(BICYCLO[2.2.1]HEPTAN-2-YL)ETHANE-1-SULFONYL CHLORIDE
CAS No: 753454-46-5 Catalog No: AG01B3IT MDL No:MFCD26064589
Product Description
Catalog Number:
AG01B3IT
Chemical Name:
2-(BICYCLO[2.2.1]HEPTAN-2-YL)ETHANE-1-SULFONYL CHLORIDE
CAS Number:
753454-46-5
Molecular Formula:
C9H15ClO2S
Molecular Weight:
222.7322
MDL Number:
MFCD26064589
IUPAC Name:
2-(2-bicyclo[2.2.1]heptanyl)ethanesulfonyl chloride
InChI:
InChI=1S/C9H15ClO2S/c10-13(11,12)4-3-9-6-7-1-2-8(9)5-7/h7-9H,1-6H2
InChI Key:
BOYOENMDTZTPPR-UHFFFAOYSA-N
SMILES:
ClS(=O)(=O)CCC1CC2CC1CC2
Properties
Complexity:
281
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:
3
Topological Polar Surface Area:
42.5A^2
Undefined Atom Stereocenter Count:
3
Undefined Bond Stereocenter Count:
0
XLogP3:
3.2
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