CAS
906353-01-3 Purity
96%
906353-01-3 Purity
96%
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4-Thiazolecarboxylicacid,2-(4-morpholinyl)-
CAS
906353-04-6
Catalog Number
ACM906353046
Category
Other Products
Molecular Weight
214.24
Molecular Formula
C8H10N2O3S
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Specification
Synonyms
4-Carboxy-2-(morpholin-4-yl)-1,3-thiazole, 4-(4-Carboxy-1,3-thiazol-2-yl)morpholine
IUPAC Name
2-morpholin-4-yl-1,3-thiazole-4-carboxylic acid
Canonical SMILES
C1COCCN1C2=NC(=CS2)C(=O)O
InChI Key
JXQGQYNBVNKCAK-UHFFFAOYSA-N
Boiling Point
435ºC at 760 mmHg
Melting Point
175-177ºC
Flash Point
216.9ºC
Density
1.447g/cm³
Exact Mass
214.04100
H-Bond Acceptor
6
H-Bond Donor
1
What is the molecular formula of 4-Thiazolecarboxylic acid, 2-(4-morpholinyl)?
The molecular formula is C8H10N2O3S.
What is the molecular weight of the compound?
The molecular weight is 214.24 g/mol.
What is the IUPAC name of the compound?
The IUPAC name is 2-morpholin-4-yl-1,3-thiazole-4-carboxylic acid.
What is the Canonical SMILES representation of the compound?
The Canonical SMILES is C1COCCN1C2=NC(=CS2)C(=O)O.
How many hydrogen bond donor counts does the compound have?
The compound has 1 hydrogen bond donor count.
How many hydrogen bond acceptor counts does the compound have?
The compound has 6 hydrogen bond acceptor counts.
What is the topological polar surface area of the compound?
The topological polar surface area is 90.9 Ų.
Does the compound have any defined atom stereocenter counts?
No, the compound has 0 defined atom stereocenter counts.
Is the compound canonicalized?
Yes, the compound is canonicalized.
What is the InChIKey of the compound?
The InChIKey is JXQGQYNBVNKCAK-UHFFFAOYSA-N.
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CAS
906353-03-5 Purity
96%
906353-03-5 Purity
96%
