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S-(2-Hydroxyethyl)-D-cysteine

HCID 11622387
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Basic informationNames & identifiersPropertiesChemistry & industryRelated reactionsCompound notes
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Basic information

CAS
85955-36-8
Standard SMILES
N[C@H](CSCCO)C(=O)O
InChIKey
MWFRVMDVLYIXJF-SCSAIBSYSA-N
Molecular formula
C5H11NO3S
Average molar mass
165.21 g/mol
Monoisotopic mass
165.04596439

Names & identifiers

Preferred name
S-(2-Hydroxyethyl)-D-cysteine
IUPAC
(2S)-2-amino-3-(2-hydroxyethylsulfanyl)propanoic acid
English name
S-2-Hydroxyethyl-D-cysteine
Molecular formula
C5H11NO3S
Molecular weight
165.21

Names & synonyms

85955-36-8S-(2-Hydroxyethyl)-D-cysteineDTXSID50469562RefChem:379413DTXCID00420380(S)-2-Amino-3-((2-hydroxyethyl)thio)propanoic acid(2S)-2-amino-3-(2-hydroxyethylsulfanyl)propanoic acidS-2-Hydroxyethyl-D-cysteineSCHEMBL29588339(2S)-2-AMINO-3-[(2-HYDROXYETHYL)SULFANYL]PROPANOIC ACIDAKOS006284736(S)-2-Amino-3-(2-hydroxyethylthio)propanoic acid
Show more names
Fudosteine Impurity 20L-β-(S-ethanolthio) alanineD-Cysteine, S-(2-hydroxyethyl)-S-2-Hydroxyethyl-D-cysteine USP/EP/BP(R)-2-Amino-3-(ethanolthio)propanoic acid
(S)-2-Amino-3-((2-hydroxyethyl)thio)propanoicacid(2~{S})-2-azanyl-3-(2-hydroxyethylsulfanyl)propanoic acid

Database identifiers

CAS
85955-36-8
PubChem CID
11622387
DTXSID
DTXSID50469562
Nikkaji
J2.240.369I

Properties

Computed structural properties

XLogP
-3.4
Topological polar surface area
109 Ų
Hydrogen bond donors
3
Hydrogen bond acceptors
5
Rotatable bonds
5
Heavy atoms
10
Formal charge
0
Complexity
109

Physicochemical properties

Boiling point
379.9 · 379.9±42.0 °C(Predicted)
Density
1.362 · 1.362±0.06 g/cm3(Predicted)
pka
2.07 · 2.07±0.10(Predicted)

Chemistry & industry

Suppliers9 total

Dayang Chem (Hangzhou) Co.,Ltd.+86-0571-88938639 17705817739 · [email protected]
广州隽唐科技有限公司020-36607679 13502246435 · [email protected]
深圳菲斯生物科技有限公司0755-83725350 13380397412 · [email protected]
TLC梯尔希(南京)药物研发有限公司18012923235 · [email protected]
深圳振强药物研发有限公司+86-0755-66853366 +86-13670046396 · [email protected]
江苏洪珉药业有限公司18221292452 · [email protected]
Nextpeptide Inc+86-0571-81612335 +8613336028439 · [email protected]
重庆卡兰医药有限公司[email protected]
Dideu Industries Group Limited+86-29-81148696 +86-15129568250 · [email protected]

Related reactions

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Compound notes

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