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1803587-82-7 | (5-tert-butyl-1,2-oxazol-3-yl)methanesulfonyl chloride
CAS No: 1803587-82-7 Catalog No: AG01BE54 MDL No:MFCD28118295
Product Description
Catalog Number:
AG01BE54
Chemical Name:
(5-tert-butyl-1,2-oxazol-3-yl)methanesulfonyl chloride
CAS Number:
1803587-82-7
Molecular Formula:
C8H12ClNO3S
Molecular Weight:
237.7038
MDL Number:
MFCD28118295
IUPAC Name:
(5-tert-butyl-1,2-oxazol-3-yl)methanesulfonyl chloride
InChI:
InChI=1S/C8H12ClNO3S/c1-8(2,3)7-4-6(10-13-7)5-14(9,11)12/h4H,5H2,1-3H3
InChI Key:
RMFLEGXHBIWIGT-UHFFFAOYSA-N
SMILES:
CC(c1onc(c1)CS(=O)(=O)Cl)(C)C
Properties
Complexity:
291
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
237.023g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
237.698g/mol
Monoisotopic Mass:
237.023g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
68.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.1
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