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143731-32-2 | 1,2-Butanediol, 1-(4-methylbenzenesulfonate), (2S)-
CAS No: 143731-32-2 Catalog No: AG001IAP MDL No:
Product Description
Catalog Number:
AG001IAP
Chemical Name:
1,2-Butanediol, 1-(4-methylbenzenesulfonate), (2S)-
CAS Number:
143731-32-2
IUPAC Name:
[(2S)-2-hydroxybutyl] 4-methylbenzenesulfonate
InChI:
InChI=1S/C11H16O4S/c1-3-10(12)8-15-16(13,14)11-6-4-9(2)5-7-11/h4-7,10,12H,3,8H2,1-2H3/t10-/m0/s1
InChI Key:
UVSOURZMHXZMJW-JTQLQIEISA-N
Properties
Complexity:
286
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Exact Mass:
244.077g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
244.305g/mol
Monoisotopic Mass:
244.077g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
72A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7
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