1-Azetidinesulfonic acid, 2-methyl-4-oxo-3-[[(phenylmethoxy)carbonyl]amino]-, sodium salt (1:1), (2S,3S)-
CAS Registry Number®
115887-91-7
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CAS Name
1-Azetidinesulfonic acid, 2-methyl-4-oxo-3-[[(phenylmethoxy)carbonyl]amino]-, sodium salt (1:1), (2S,3S)-Molecular Formula
C12H14N2O6S.NaCite this Page
1-Azetidinesulfonic acid, 2-methyl-4-oxo-3-[[(phenylmethoxy)carbonyl]amino]-, sodium salt (1:1), (2S,3S)-. CAS Common Chemistry. CAS, a division of the American Chemical Society, n.d. http://commonchemistry.cas.org/detail?cas_rn=115887-91-7 (retrieved ) (CAS RN: 115887-91-7). Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).Compound Properties
Melting Point (1)
127-129 °C
Source(s)
- (1) Denotes property values from the ZIC/VINITI data file provided by InfoChem.
Other Names and Identifiers
InChI
InChI=1S/C12H14N2O6S.Na/c1-8-10(11(15)14(8)21(17,18)19)13-12(16)20-7-9-5-3-2-4-6-9;/h2-6,8,10H,7H2,1H3,(H,13,16)(H,17,18,19);/t8-,10-;/m0./s1
InChIKey
InChIKey=KBEBCJMJULGVOR-GNAZCLTHSA-N
SMILES
S(=O)(=O)(O)N1[C@@H](C)[C@H](NC(OCC2=CC=CC=C2)=O)C1=O.[Na]
Canonical SMILES
[Na].O=C(OCC=1C=CC=CC1)NC2C(=O)N(C2C)S(=O)(=O)O
Other Names for this Substance
- 1-Azetidinesulfonic acid, 2-methyl-4-oxo-3-[[(phenylmethoxy)carbonyl]amino]-, sodium salt (1:1), (2S,3S)-
- 1-Azetidinesulfonic acid, 2-methyl-4-oxo-3-[[(phenylmethoxy)carbonyl]amino]-, monosodium salt, (2S-trans)-