Home Other Building Blocks METHYL 3-AMINO-5-FORMYLTHIOPHENE-2-CARBOXYLATE

METHYL 3-AMINO-5-FORMYLTHIOPHENE-2-CARBOXYLATE

CAS No.:
946605-33-0
Catalog Number:
AG01E3MD
Molecular Formula:
C7H7NO3S
Molecular Weight:
185.2004
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Product Description
Catalog Number:
AG01E3MD
Chemical Name:
METHYL 3-AMINO-5-FORMYLTHIOPHENE-2-CARBOXYLATE
CAS Number:
946605-33-0
Molecular Formula:
C7H7NO3S
Molecular Weight:
185.2004
MDL Number:
MFCD20702029
IUPAC Name:
methyl 3-amino-5-formylthiophene-2-carboxylate
InChI:
InChI=1S/C7H7NO3S/c1-11-7(10)6-5(8)2-4(3-9)12-6/h2-3H,8H2,1H3
InChI Key:
NGGDLRMKSBBWKQ-UHFFFAOYSA-N
SMILES:
COC(=O)c1sc(cc1N)C=O
Properties
Complexity:
197  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
185.015g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
185.197g/mol
Monoisotopic Mass:
185.015g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
97.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.5  
Properties