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Articaine Impurity 17

CAT: 1299-RM-A181017-01Size: 10 mgDry Ice: NoHazardous: No
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CAT#:1299-RM-A181017-01Size:10 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
23968-18-5
Synonyms
3-amino-4-methylthiophene-2-carboxylic acid
Molecular Formula
C6H7NO2S
Molecular Weight
157.19
Target Alternative Name
Articaine
Product Name Synonym
3-amino-4-methylthiophene-2-carboxylic acid

Chemical Information

3-Amino-4-methylthiophene-2-carboxylic acid
CAS Number23968-18-5
PubChem CID14989678
IUPAC Name3-amino-4-methylthiophene-2-carboxylic acid
Molecular FormulaC6H7NO2S
Molecular Weight157.19
XLogP1.7
Topological Polar Surface Area91.6
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count4
Rotatable Bond Count1
Heavy Atom Count10
Formal Charge0
Complexity151
SMILES
CC1=CSC(=C1N)C(=O)O
InChI
InChI=1S/C6H7NO2S/c1-3-2-10-5(4(3)7)6(8)9/h2H,7H2,1H3,(H,8,9)
InChIKey
AKXYKVHNZQCHMF-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 3-Amino-4-methylthiophene-2-carboxylic acid
CAS: 23968-18-5
CID: 14989678
Formula: C6H7NO2S
MW: 157.19
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight157.19
XLogP31.7
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count4
Rotatable Bond Count1
Exact Mass157.01974964
Monoisotopic Mass157.01974964
Topological Polar Surface Area91.6 Ų
Heavy Atom Count10
Formal Charge0
Complexity151
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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AR-A02610-01Articaine EP Impurity J
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