CAS
92952-73-3 Purity
---
92952-73-3 Purity
---
Inquiry Basket
2-Carboxyethyl methanethiosulfonate
CAS
92953-12-3
Catalog Number
ACM92953123
Category
Other Products
Molecular Weight
184.233920 [g/mol]
Molecular Formula
C4H8O4S2
If you have any other questions or need other size, please get a quote.
- Product Description
- Case Study
- Custom Reviews
- Custom Q&A
- Synthetic Use
- Related Resources
Specification
Synonyms
3-[(Methylsulfonyl)thio]propanoic Acid; MTSCE
IUPAC Name
3-methylsulfonylsulfanylpropanoic acid
Canonical SMILES
CS(=O)(=O)SCCC(=O)O
InChI Key
ZKTVHIQLDQIQHX-UHFFFAOYSA-N
Melting Point
44-48ºC
Appearance
Off-White to Pale Yellow Solid
Exact Mass
183.98600
H-Bond Acceptor
5
H-Bond Donor
1
What is the molecular formula of 2-Carboxyethyl methanethiosulfonate?
The molecular formula of 2-Carboxyethyl methanethiosulfonate is C4H8O4S2.
What is the molecular weight of 2-Carboxyethyl methanethiosulfonate?
The molecular weight of 2-Carboxyethyl methanethiosulfonate is 184.2 g/mol.
What is the IUPAC name of 2-Carboxyethyl methanethiosulfonate?
The IUPAC name of 2-Carboxyethyl methanethiosulfonate is 3-methylsulfonylsulfanylpropanoic acid.
What is the InChI of 2-Carboxyethyl methanethiosulfonate?
The InChI of 2-Carboxyethyl methanethiosulfonate is InChI=1S/C4H8O4S2/c1-10(7,8)9-3-2-4(5)6/h2-3H2,1H3,(H,5,6).
What is the InChIKey of 2-Carboxyethyl methanethiosulfonate?
The InChIKey of 2-Carboxyethyl methanethiosulfonate is ZKTVHIQLDQIQHX-UHFFFAOYSA-N.
What is the canonical SMILES of 2-Carboxyethyl methanethiosulfonate?
The canonical SMILES of 2-Carboxyethyl methanethiosulfonate is CS(=O)(=O)SCCC(=O)O.
What is the CAS number of 2-Carboxyethyl methanethiosulfonate?
The CAS number of 2-Carboxyethyl methanethiosulfonate is 92953-12-3.
What is the XLogP3-AA value of 2-Carboxyethyl methanethiosulfonate?
The XLogP3-AA value of 2-Carboxyethyl methanethiosulfonate is -0.5.
Is 2-Carboxyethyl methanethiosulfonate a canonicalized compound?
Yes, 2-Carboxyethyl methanethiosulfonate is a canonicalized compound.
Recommended Products
![6-Chloro-2-[4-[ethyl(2-hydroxyethyl)amino]phenyl]-1-methylbenz[cd]indolium acetate](https://resource.alfa-chemistry.com/structure/92952-73-3.gif)
