CAS
94134-42-6 Purity
96%
94134-42-6 Purity
96%
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Methyl 3-(chlorocarbonyl)thiazolidine-4-carboxylate
CAS
94134-48-2
Catalog Number
ACM94134482
Category
Other Products
Molecular Weight
209.650620 [g/mol]
Molecular Formula
C6H8ClNO3S
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Specification
Synonyms
MolPort-004-762-865, EINECS 302-817-0, CID3023680, Methyl 3-(chlorocarbonyl)thiazolidine-4-carboxylate, 94134-48-2
IUPAC Name
methyl 3-carbonochloridoyl-1,3-thiazolidine-4-carboxylate
SMILES
COC(=O)C1CSCN1C(=O)Cl
InChI Key
CORDKGQLHLMDGC-UHFFFAOYSA-N
Boiling Point
344.5ºC at 760mmHg
Flash Point
162.2ºC
Density
1.466g/cm³
EC Number
302-817-0
Exact Mass
208.99100
H-Bond Acceptor
3
H-Bond Donor
0
What is the molecular formula of Methyl 3-(chlorocarbonyl)thiazolidine-4-carboxylate?
The molecular formula is C6H8ClNO3S.
When was Methyl 3-(chlorocarbonyl)thiazolidine-4-carboxylate created on PubChem?
It was created on 2005-08-08.
What is the IUPAC Name of Methyl 3-(chlorocarbonyl)thiazolidine-4-carboxylate?
The IUPAC Name is methyl 3-carbonochloridoyl-1,3-thiazolidine-4-carboxylate.
What is the Canonical SMILES of Methyl 3-(chlorocarbonyl)thiazolidine-4-carboxylate?
The Canonical SMILES is COC(=O)C1CSCN1C(=O)Cl.
What is the molecular weight of Methyl 3-(chlorocarbonyl)thiazolidine-4-carboxylate?
The molecular weight is 209.65 g/mol.
How many hydrogen bond acceptor counts does Methyl 3-(chlorocarbonyl)thiazolidine-4-carboxylate have?
It has 4 hydrogen bond acceptor counts.
What is the exact mass of Methyl 3-(chlorocarbonyl)thiazolidine-4-carboxylate?
The exact mass is 208.9913420 g/mol.
How many rotatable bond counts does Methyl 3-(chlorocarbonyl)thiazolidine-4-carboxylate have?
It has 2 rotatable bond counts.
Is Methyl 3-(chlorocarbonyl)thiazolidine-4-carboxylate a canonicalized compound?
Yes, it is canonicalized.
What is the topological polar surface area of Methyl 3-(chlorocarbonyl)thiazolidine-4-carboxylate?
The topological polar surface area is 71.9 Ų.
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