AF70419
40133-07-1 | 4,5,6,7-Tetrahydro-benzo[b]thiophene-2-carboxylic acid
Manufacturer: A2B Chem
The price for this product is unavailable. Please request a quote
CatalogNumber
AF70419
ChemicalName
4,5,6,7-Tetrahydro-benzo[b]thiophene-2-carboxylic acid
CasNumber
40133-07-1
MolecularFormula
C9H10O2S
MolecularWeight
182.2395
MdlNumber
MFCD00464469
Smiles
OC(=O)c1cc2c(s1)CCCC2
Complexity
193
Covalently-bondedUnitCount
1
HeavyAtomCount
12
HydrogenBondAcceptorCount
3
HydrogenBondDonorCount
1
RotatableBondCount
1
Xlogp3
2.7
Compare Similar Items
Show Difference
CatalogNumber: AF70419
ChemicalName: 4,5,6,7-Tetrahydro-benzo[b]thiophene-2-carboxylic acid
CasNumber: 40133-07-1
MolecularFormula: C9H10O2S
MolecularWeight: 182.2395
MdlNumber: MFCD00464469
Smiles: OC(=O)c1cc2c(s1)CCCC2
Complexity: 193
Covalently-bondedUnitCount: 1
HeavyAtomCount: 12
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: 1
RotatableBondCount: 1
Xlogp3: 2.7
CatalogNumber:
AF70419
ChemicalName:
4,5,6,7-Tetrahydro-benzo[b]thiophene-2-carboxylic acid
CasNumber:
40133-07-1
MolecularFormula:
C9H10O2S
MolecularWeight:
182.2395
MdlNumber:
MFCD00464469
Smiles:
OC(=O)c1cc2c(s1)CCCC2
Complexity:
193
Covalently-bondedUnitCount:
1
HeavyAtomCount:
12
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
1
RotatableBondCount:
1
Xlogp3:
2.7
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: BrCc1ccc(cc1)c1onc(n1)C
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
BrCc1ccc(cc1)c1onc(n1)C
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: AF70421
ChemicalName: Ethyl 6-iodo-4-oxo-4h-chromene-2-carboxylate
CasNumber: 35204-44-5
MolecularFormula: C12H9IO4
MolecularWeight: 344.1019
MdlNumber: MFCD00100378
Smiles: CCOC(=O)c1cc(=O)c2c(o1)ccc(c2)I
Complexity: 364
Covalently-bondedUnitCount: 1
HeavyAtomCount: 17
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: __
RotatableBondCount: 3
Xlogp3: 3
CatalogNumber:
AF70421
ChemicalName:
Ethyl 6-iodo-4-oxo-4h-chromene-2-carboxylate
CasNumber:
35204-44-5
MolecularFormula:
C12H9IO4
MolecularWeight:
344.1019
MdlNumber:
MFCD00100378
Smiles:
CCOC(=O)c1cc(=O)c2c(o1)ccc(c2)I
Complexity:
364
Covalently-bondedUnitCount:
1
HeavyAtomCount:
17
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
__
RotatableBondCount:
3
Xlogp3:
3
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: Oc1ccc2c(c1)c(C)cc(n2)O
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
Oc1ccc2c(c1)c(C)cc(n2)O
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__