Home Sulfos 2-methylbenzo[d]oxazole-6-sulfonyl chloride

2-methylbenzo[d]oxazole-6-sulfonyl chloride

CAS No.:
52206-51-6
Catalog Number:
AG00DJCE
Molecular Formula:
C8H6ClNO3S
Molecular Weight:
231.6561
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Product Description
Catalog Number:
AG00DJCE
Chemical Name:
2-methylbenzo[d]oxazole-6-sulfonyl chloride
CAS Number:
52206-51-6
Molecular Formula:
C8H6ClNO3S
Molecular Weight:
231.6561
MDL Number:
MFCD19200560
IUPAC Name:
2-methyl-1,3-benzoxazole-6-sulfonyl chloride
InChI:
InChI=1S/C8H6ClNO3S/c1-5-10-7-3-2-6(14(9,11)12)4-8(7)13-5/h2-4H,1H3
InChI Key:
NHBYTQPVOGBVBM-UHFFFAOYSA-N
SMILES:
Cc1nc2c(o1)cc(cc2)S(=O)(=O)Cl
Properties
Complexity:
313  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
230.976g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
231.65g/mol
Monoisotopic Mass:
230.976g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
68.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2  
Properties