AA32814
1197-12-2 | Methyl 4,5-dichloro-1h-pyrrole-2-carboxylate
Manufacturer: A2B Chem
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CatalogNumber
AA32814
ChemicalName
Methyl 4,5-dichloro-1h-pyrrole-2-carboxylate
CasNumber
1197-12-2
MolecularFormula
C6H5Cl2NO2
MolecularWeight
194.0154
MdlNumber
MFCD13193111
Smiles
COC(=O)c1[nH]c(c(c1)Cl)Cl
Complexity
165
Covalently-bondedUnitCount
1
HeavyAtomCount
11
HydrogenBondAcceptorCount
2
HydrogenBondDonorCount
1
RotatableBondCount
2
Xlogp3
2.5
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CatalogNumber: AA32814
ChemicalName: Methyl 4,5-dichloro-1h-pyrrole-2-carboxylate
CasNumber: 1197-12-2
MolecularFormula: C6H5Cl2NO2
MolecularWeight: 194.0154
MdlNumber: MFCD13193111
Smiles: COC(=O)c1[nH]c(c(c1)Cl)Cl
Complexity: 165
Covalently-bondedUnitCount: 1
HeavyAtomCount: 11
HydrogenBondAcceptorCount: 2
HydrogenBondDonorCount: 1
RotatableBondCount: 2
Xlogp3: 2.5
CatalogNumber:
AA32814
ChemicalName:
Methyl 4,5-dichloro-1h-pyrrole-2-carboxylate
CasNumber:
1197-12-2
MolecularFormula:
C6H5Cl2NO2
MolecularWeight:
194.0154
MdlNumber:
MFCD13193111
Smiles:
COC(=O)c1[nH]c(c(c1)Cl)Cl
Complexity:
165
Covalently-bondedUnitCount:
1
HeavyAtomCount:
11
HydrogenBondAcceptorCount:
2
HydrogenBondDonorCount:
1
RotatableBondCount:
2
Xlogp3:
2.5
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: OCc1cccc(n1)C(=O)O
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
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CasNumber:
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MolecularFormula:
__
MolecularWeight:
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MdlNumber:
__
Smiles:
OCc1cccc(n1)C(=O)O
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
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Xlogp3:
__
CatalogNumber: AA32816
ChemicalName: 3',4'-Dihydroxyacetophenone
CasNumber: 1197-09-7
MolecularFormula: C8H8O3
MolecularWeight: 152.1473
MdlNumber: MFCD00192301
Smiles: CC(=O)c1ccc(c(c1)O)O
Complexity: 155
Covalently-bondedUnitCount: 1
HeavyAtomCount: 11
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: 2
RotatableBondCount: 1
Xlogp3: 1.5
CatalogNumber:
AA32816
ChemicalName:
3',4'-Dihydroxyacetophenone
CasNumber:
1197-09-7
MolecularFormula:
C8H8O3
MolecularWeight:
152.1473
MdlNumber:
MFCD00192301
Smiles:
CC(=O)c1ccc(c(c1)O)O
Complexity:
155
Covalently-bondedUnitCount:
1
HeavyAtomCount:
11
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
2
RotatableBondCount:
1
Xlogp3:
1.5
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: CCC(=O)c1cccc(c1)N
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
CCC(=O)c1cccc(c1)N
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__