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174626-25-6 | Carbamic acid, N-[4-[(methylsulfonyl)oxy]butyl]-, 1,1-dimethylethyl ester
CAS No: 174626-25-6 Catalog No: AG001ZT9 MDL No:
Product Description
Catalog Number:
AG001ZT9
Chemical Name:
Carbamic acid, N-[4-[(methylsulfonyl)oxy]butyl]-, 1,1-dimethylethyl ester
CAS Number:
174626-25-6
Molecular Formula:
C10H21NO5S
Molecular Weight:
267.3424
IUPAC Name:
4-[(2-methylpropan-2-yl)oxycarbonylamino]butyl methanesulfonate
InChI:
InChI=1S/C10H21NO5S/c1-10(2,3)16-9(12)11-7-5-6-8-15-17(4,13)14/h5-8H2,1-4H3,(H,11,12)
InChI Key:
LYPFMWLZWKNRRA-UHFFFAOYSA-N
SMILES:
O=C(OC(C)(C)C)NCCCCOS(=O)(=O)C
Properties
Complexity:
326
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
267.114g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
267.34g/mol
Monoisotopic Mass:
267.114g/mol
Rotatable Bond Count:
8
Topological Polar Surface Area:
90.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.1
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