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182220-99-1 | 1-Propanesulfonic acid, 2-amino-1,3-dihydroxy-
CAS No: 182220-99-1 Catalog No: AG0023HX MDL No:
Product Description
Catalog Number:
AG0023HX
Chemical Name:
1-Propanesulfonic acid, 2-amino-1,3-dihydroxy-
CAS Number:
182220-99-1
Molecular Formula:
C3H9NO5S
Molecular Weight:
171.1723
IUPAC Name:
2-amino-1,3-dihydroxypropane-1-sulfonic acid
InChI:
InChI=1S/C3H9NO5S/c4-2(1-5)3(6)10(7,8)9/h2-3,5-6H,1,4H2,(H,7,8,9)
InChI Key:
OVYXGWQCPHZQAZ-UHFFFAOYSA-N
SMILES:
OCC(C(S(=O)(=O)O)O)N
Properties
Complexity:
182
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
171.02g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
4
Isotope Atom Count:
0
Molecular Weight:
171.167g/mol
Monoisotopic Mass:
171.02g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
129A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
-5.2
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