Products for Research Use Only
RegisterLogin

Thiomorpholine-3-carboxylic acid

CAT: 0127-OR6324-01Size: 250 mgDry Ice: NoHazardous: No
Product image 1
1 / 1
CAT#:0127-OR6324-01Size:250 mg
Selected
24/48H Stock Items & 2 to 6 Weeks non Stock Items.
Quick Request Actions
CAS Number
20960-92-3
Synonyms
1,4-Thiazinane-3-carboxylic acid, Tetrahydro-2H-1,4-thiazinane-3-carboxylic acid
MDL Number
MFCD02181162
Purity
97%
Smiles
OC(=O)C1CSCCN1
Storage Conditions
Store at 2-8°C

Chemical Information

Thiomorpholine-3-carboxylic acid

Thiomorpholine-3-carboxylic acid is a thiomorpholinemonocarboxylic acid having the carboxy group at the 3-position. It is a conjugate acid of a thiomorpholine-3-carboxylate. It is a tautomer of a thiomorpholine-3-carboxylic acid zwitterion.

CAS Number20960-92-3
PubChem CID440159
IUPAC Namethiomorpholine-3-carboxylic acid
Molecular FormulaC5H9NO2S
Molecular Weight147.20
XLogP-2.4
Topological Polar Surface Area74.6
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count4
Rotatable Bond Count1
Heavy Atom Count9
Formal Charge0
Complexity118
SMILES
C1CSCC(N1)C(=O)O
InChI
InChI=1S/C5H9NO2S/c7-5(8)4-3-9-2-1-6-4/h4,6H,1-3H2,(H,7,8)
InChIKey
JOKIQGQOKXGHDV-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Thiomorpholine-3-carboxylic acid
CAS: 20960-92-3
CID: 440159
Formula: C5H9NO2S
MW: 147.20
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight147.20
XLogP3-2.4
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count4
Rotatable Bond Count1
Exact Mass147.03539970
Monoisotopic Mass147.03539970
Topological Polar Surface Area74.6 Ų
Heavy Atom Count9
Formal Charge0
Complexity118
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count1
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

Related Products

CatalogName
OR315576-01Thiomorpholine-2-carboxylic acid
OR313075-01N-BOC-thiomorpholine-2-carboxylic acid
OR6523-01Thiomorpholine
OR127823- (4-methoxyphenyl) thiomorpholine
OR127853- (2-Chlorophenyl) thiomorpholine
OR3123493- (Hydroxymethyl) thiomorpholine-3-carbonitrile
OR1031088-013- (Tert-butyl) thiomorpholine
OR1445Ethyl thiomorpholine-3-carboxylate
OR1096845-014- (3-Nitrophenyl) thiomorpholine
PC2013593- (4-Fluorophenyl) thiomorpholine

Alternative Products

CatalogName
abx180907-01Thiomorpholine-3-carboxylic acid
291506-01(R) -Thiomorpholine-3-carboxylic acid
sc-272600Thiomorpholine-3-carboxylic acid hydrochloride
sc-280141Thiomorpholine-2-carboxylic acid
241669-01(R) -Thiomorpholine-3-carboxylic acid 99+%
291497-011,4-Thiomorpholine-3-carboxylic acid
sc-272598Thiomorpholine-3-carboxylic acid ethyl ester
241588-01(R) -4-Boc-thiomorpholine-3-carboxylic acid
sc-296236(R) -4-Z-thiomorpholine-3-carboxylic acid
sc-272599Thiomorpholine-3-carboxylic acid ethyl ester hydrochloride

Popular Products