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MFCD01827729

CAT: 0013-GTR19156030-08Size: 200 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19156030-08Size:200 mg
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Description
MFCD01827729 is a chemical compound.
CAS Number
15854-08-7
Product Name Alternative
ETHYL 2-AMINO-4- (4-METHYLPHENYL) -3-THIOPHENECARBOXYLATE
Purity
>98% (HPLC)
Solubility
DMSO:10 mM
Smiles
CCOC (=O) C1=C (SC=C1C2=CC=C (C=C2) C) N
Molecular Formula
C14H15NO2S
Molecular Weight
261.34
Storage Conditions
Storage temperature: -20°C. Stability: ≥ 2 years
Notes
For research use only.

Chemical Information

Ethyl 2-amino-4-p-tolylthiophene-3-carboxylate
CAS Number15854-08-7
PubChem CID705801
IUPAC Nameethyl 2-amino-4-(4-methylphenyl)thiophene-3-carboxylate
Molecular FormulaC14H15NO2S
Molecular Weight261.34
XLogP4
Topological Polar Surface Area80.6
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count4
Rotatable Bond Count4
Heavy Atom Count18
Formal Charge0
Complexity290
SMILES
CCOC(=O)C1=C(SC=C1C2=CC=C(C=C2)C)N
InChI
InChI=1S/C14H15NO2S/c1-3-17-14(16)12-11(8-18-13(12)15)10-6-4-9(2)5-7-10/h4-8H,3,15H2,1-2H3
InChIKey
GOQSMGNEJVWZIG-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Ethyl 2-amino-4-p-tolylthiophene-3-carboxylate
CAS: 15854-08-7
CID: 705801
Formula: C14H15NO2S
MW: 261.34
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight261.34
XLogP34
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count4
Rotatable Bond Count4
Exact Mass261.08234989
Monoisotopic Mass261.08234989
Topological Polar Surface Area80.6 Ų
Heavy Atom Count18
Formal Charge0
Complexity290
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

Alternative Products

CatalogName
MBS3613356-01MFCD01827729

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