Home Sulfos 3,4-dihydro-2H-1-benzopyran-6-sulfonyl chloride

3,4-dihydro-2H-1-benzopyran-6-sulfonyl chloride

CAS No.:
946409-11-6
Catalog Number:
AG00IIEN
Molecular Formula:
C9H9ClO3S
Molecular Weight:
232.6840
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Product Description
Catalog Number:
AG00IIEN
Chemical Name:
3,4-dihydro-2H-1-benzopyran-6-sulfonyl chloride
CAS Number:
946409-11-6
Molecular Formula:
C9H9ClO3S
Molecular Weight:
232.6840
MDL Number:
MFCD09897729
IUPAC Name:
3,4-dihydro-2H-chromene-6-sulfonyl chloride
InChI:
InChI=1S/C9H9ClO3S/c10-14(11,12)8-3-4-9-7(6-8)2-1-5-13-9/h3-4,6H,1-2,5H2
InChI Key:
YWWYZRQBPOAOMS-UHFFFAOYSA-N
SMILES:
ClS(=O)(=O)c1ccc2c(c1)CCCO2
Properties
Complexity:
296  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
231.996g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
232.678g/mol
Monoisotopic Mass:
231.996g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
51.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3  
Properties