Methyl 2-amino-5-carbamoyl-4-methylthiophene-3-carboxylate - CAS 350996-94-0
Catalog: |
BB046867 |
Product Name: |
Methyl 2-amino-5-carbamoyl-4-methylthiophene-3-carboxylate |
CAS: |
350996-94-0 |
Synonyms: |
methyl 2-amino-5-(aminocarbonyl)-4-methylthiophene-3-carboxylate; 2-amino-5-carbamoyl-4-methyl-thiophene-3-carboxylic acid methyl ester; Methyl 2-amino-5-(aminocarbonyl)-4-methyl-3-thiophenecarboxylate |
IUPAC Name: | methyl 2-amino-5-carbamoyl-4-methylthiophene-3-carboxylate |
Description: | Methyl 2-amino-5-carbamoyl-4-methylthiophene-3-carboxylate (CAS# 350996-94-0 ) is a useful research chemical. |
Molecular Weight: | 214.24 |
Molecular Formula: | C8H10N2O3S |
Canonical SMILES: | CC1=C(SC(=C1C(=O)OC)N)C(=O)N |
InChI: | InChI=1S/C8H10N2O3S/c1-3-4(8(12)13-2)7(10)14-5(3)6(9)11/h10H2,1-2H3,(H2,9,11) |
InChI Key: | VHKVKXQMRTVIML-UHFFFAOYSA-N |
Boiling Point: | 308.8 °C at 760 mmHg |
Purity: | ≥ 95 % |
Density: | 1.39 g/cm3 |
GHS Hazard Statement: | H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]; H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]; H335 (100%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation] |
Precautionary Statement: | P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 |
Signal Word: | Warning |
Complexity: | 259 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 214.04121336 |
Formal Charge: | 0 |
Heavy Atom Count: | 14 |
Hydrogen Bond Acceptor Count: | 5 |
Hydrogen Bond Donor Count: | 2 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 214.04121336 |
Rotatable Bond Count: | 3 |
Topological Polar Surface Area: | 124 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.2 |
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