AF83968
36929-61-0 | 1-Methyl-1H-pyrrole-3-carboxylic acid
Manufacturer: A2B Chem
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CatalogNumber
AF83968
ChemicalName
1-Methyl-1H-pyrrole-3-carboxylic acid
CasNumber
36929-61-0
MolecularFormula
C6H7NO2
MolecularWeight
125.1253
MdlNumber
MFCD11111733
Smiles
Cn1ccc(c1)C(=O)O
Complexity
124
Covalently-bondedUnitCount
1
HeavyAtomCount
9
HydrogenBondAcceptorCount
2
HydrogenBondDonorCount
1
RotatableBondCount
1
Xlogp3
0.2
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CatalogNumber: AF83968
ChemicalName: 1-Methyl-1H-pyrrole-3-carboxylic acid
CasNumber: 36929-61-0
MolecularFormula: C6H7NO2
MolecularWeight: 125.1253
MdlNumber: MFCD11111733
Smiles: Cn1ccc(c1)C(=O)O
Complexity: 124
Covalently-bondedUnitCount: 1
HeavyAtomCount: 9
HydrogenBondAcceptorCount: 2
HydrogenBondDonorCount: 1
RotatableBondCount: 1
Xlogp3: 0.2
CatalogNumber:
AF83968
ChemicalName:
1-Methyl-1H-pyrrole-3-carboxylic acid
CasNumber:
36929-61-0
MolecularFormula:
C6H7NO2
MolecularWeight:
125.1253
MdlNumber:
MFCD11111733
Smiles:
Cn1ccc(c1)C(=O)O
Complexity:
124
Covalently-bondedUnitCount:
1
HeavyAtomCount:
9
HydrogenBondAcceptorCount:
2
HydrogenBondDonorCount:
1
RotatableBondCount:
1
Xlogp3:
0.2
CatalogNumber: AF83969
ChemicalName: Tetrahydrofuran-3-boronic acid pinacol ester
CasNumber: 331958-90-8
MolecularFormula: C10H19BO3
MolecularWeight: 198.0671
MdlNumber: MFCD09878900
Smiles: CC1(C)OB(OC1(C)C)C1COCC1
Complexity: 211
Covalently-bondedUnitCount: 1
HeavyAtomCount: 14
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: __
RotatableBondCount: 1
Xlogp3: __
CatalogNumber:
AF83969
ChemicalName:
Tetrahydrofuran-3-boronic acid pinacol ester
CasNumber:
331958-90-8
MolecularFormula:
C10H19BO3
MolecularWeight:
198.0671
MdlNumber:
MFCD09878900
Smiles:
CC1(C)OB(OC1(C)C)C1COCC1
Complexity:
211
Covalently-bondedUnitCount:
1
HeavyAtomCount:
14
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
__
RotatableBondCount:
1
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: CCOC(=O)c1ccccc1NC
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
CCOC(=O)c1ccccc1NC
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: Nc1ccc(cn1)c1ccccn1
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
Nc1ccc(cn1)c1ccccn1
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__