Propyl 2-amino-5-carbamoyl-4-methylthiophene-3-carboxylate - CAS 438532-84-4
Catalog: |
BB044718 |
Product Name: |
Propyl 2-amino-5-carbamoyl-4-methylthiophene-3-carboxylate |
CAS: |
438532-84-4 |
Synonyms: |
propyl 2-amino-5-(aminocarbonyl)-4-methylthiophene-3-carboxylate; 2-Amino-5-carbamoyl-4-methyl-thiophene-3-carboxylic acid propyl ester; Propyl 2-amino-5-carbamoyl-4-methyl-3-thiophenecarboxylate |
IUPAC Name: | propyl 2-amino-5-carbamoyl-4-methylthiophene-3-carboxylate |
Description: | Propyl 2-amino-5-carbamoyl-4-methylthiophene-3-carboxylate (CAS# 438532-84-4 ) is a useful research chemical. |
Molecular Weight: | 242.30 |
Molecular Formula: | C10H14N2O3S |
Canonical SMILES: | CCCOC(=O)C1=C(SC(=C1C)C(=O)N)N |
InChI: | InChI=1S/C10H14N2O3S/c1-3-4-15-10(14)6-5(2)7(8(11)13)16-9(6)12/h3-4,12H2,1-2H3,(H2,11,13) |
InChI Key: | IOHDSTJMBNLWNP-UHFFFAOYSA-N |
Boiling Point: | 337.9±42.0 °C (Predicted) |
Density: | 1.295±0.06 g/cm3 (Predicted) |
Complexity: | 285 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 242.07251349 |
Formal Charge: | 0 |
Heavy Atom Count: | 16 |
Hydrogen Bond Acceptor Count: | 5 |
Hydrogen Bond Donor Count: | 2 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 242.07251349 |
Rotatable Bond Count: | 5 |
Topological Polar Surface Area: | 124 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2.1 |
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