AB46511
89499-43-4 | 4-Amino-thiophene-2-carboxylic acid methyl ester
Manufacturer: A2B Chem
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CatalogNumber
AB46511
ChemicalName
4-Amino-thiophene-2-carboxylic acid methyl ester
CasNumber
89499-43-4
MolecularFormula
C6H7NO2S
MolecularWeight
157.1903
MdlNumber
MFCD07368326
Smiles
COC(=O)c1cc(cs1)N
Complexity
140
Covalently-bondedUnitCount
1
HeavyAtomCount
10
HydrogenBondAcceptorCount
4
HydrogenBondDonorCount
1
RotatableBondCount
2
Xlogp3
1.1
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CatalogNumber: AB46511
ChemicalName: 4-Amino-thiophene-2-carboxylic acid methyl ester
CasNumber: 89499-43-4
MolecularFormula: C6H7NO2S
MolecularWeight: 157.1903
MdlNumber: MFCD07368326
Smiles: COC(=O)c1cc(cs1)N
Complexity: 140
Covalently-bondedUnitCount: 1
HeavyAtomCount: 10
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: 1
RotatableBondCount: 2
Xlogp3: 1.1
CatalogNumber:
AB46511
ChemicalName:
4-Amino-thiophene-2-carboxylic acid methyl ester
CasNumber:
89499-43-4
MolecularFormula:
C6H7NO2S
MolecularWeight:
157.1903
MdlNumber:
MFCD07368326
Smiles:
COC(=O)c1cc(cs1)N
Complexity:
140
Covalently-bondedUnitCount:
1
HeavyAtomCount:
10
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
1
RotatableBondCount:
2
Xlogp3:
1.1
CatalogNumber: AB46512
ChemicalName: Methyl 3-aminothiophene-4-carboxylate, HCl
CasNumber: 39978-14-8
MolecularFormula: C6H8ClNO2S
MolecularWeight: 193.6512
MdlNumber: MFCD00068149
Smiles: COC(=O)c1cscc1N.Cl
Complexity: 140
Covalently-bondedUnitCount: 2
HeavyAtomCount: 11
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: 2
RotatableBondCount: 2
Xlogp3: __
CatalogNumber:
AB46512
ChemicalName:
Methyl 3-aminothiophene-4-carboxylate, HCl
CasNumber:
39978-14-8
MolecularFormula:
C6H8ClNO2S
MolecularWeight:
193.6512
MdlNumber:
MFCD00068149
Smiles:
COC(=O)c1cscc1N.Cl
Complexity:
140
Covalently-bondedUnitCount:
2
HeavyAtomCount:
11
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
2
RotatableBondCount:
2
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: COC(=O)c1ccc(cc1)B(O)O
Complexity: 175
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
COC(=O)c1ccc(cc1)B(O)O
Complexity:
175
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: AB46514
ChemicalName: Methyl 4-bromobenzoate
CasNumber: 619-42-1
MolecularFormula: C8H7BrO2
MolecularWeight: 215.044
MdlNumber: MFCD00013531
Smiles: COC(=O)c1ccc(cc1)Br
Complexity: 139
Covalently-bondedUnitCount: 1
HeavyAtomCount: 11
HydrogenBondAcceptorCount: 2
HydrogenBondDonorCount: __
RotatableBondCount: 2
Xlogp3: 3
CatalogNumber:
AB46514
ChemicalName:
Methyl 4-bromobenzoate
CasNumber:
619-42-1
MolecularFormula:
C8H7BrO2
MolecularWeight:
215.044
MdlNumber:
MFCD00013531
Smiles:
COC(=O)c1ccc(cc1)Br
Complexity:
139
Covalently-bondedUnitCount:
1
HeavyAtomCount:
11
HydrogenBondAcceptorCount:
2
HydrogenBondDonorCount:
__
RotatableBondCount:
2
Xlogp3:
3