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Home > Other Building Blocks > 1378283-06-7
1378283-06-7 |
CAS No: 1378283-06-7 Catalog No: AG0013WO MDL No:
Product Description
Catalog Number:
AG0013WO
CAS Number:
1378283-06-7
Molecular Formula:
C10H18N2O6S2
Molecular Weight:
326.3897
IUPAC Name:
3-amino-1-oxothiolane-2-carboxylic acid
InChI:
InChI=1S/C5H9NO3S/c6-3-1-2-10(9)4(3)5(7)8/h3-4H,1-2,6H2,(H,7,8)
InChI Key:
CTLQISJAVPQCBH-UHFFFAOYSA-N
SMILES:
NC1CCS(=O)C1C(=O)O.NC1CCS(=O)C1C(=O)O
Properties
Complexity:
182
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
163.03g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
163.191g/mol
Monoisotopic Mass:
163.03g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
99.6A^2
Undefined Atom Stereocenter Count:
3
Undefined Bond Stereocenter Count:
0
XLogP3:
-2.9
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