AE02835
773870-17-0 | 4-(2,5-Dimethylpyrrol-1-yl)benzyl alcohol
Manufacturer: A2B Chem
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CatalogNumber
AE02835
ChemicalName
4-(2,5-Dimethylpyrrol-1-yl)benzyl alcohol
CasNumber
773870-17-0
MolecularFormula
C13H15NO
MolecularWeight
201.2643
MdlNumber
MFCD04973732
Smiles
OCc1ccc(cc1)n1c(C)ccc1C
Complexity
189
Covalently-bondedUnitCount
1
HeavyAtomCount
15
HydrogenBondAcceptorCount
1
HydrogenBondDonorCount
1
RotatableBondCount
2
Xlogp3
2.2
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CatalogNumber: AE02835
ChemicalName: 4-(2,5-Dimethylpyrrol-1-yl)benzyl alcohol
CasNumber: 773870-17-0
MolecularFormula: C13H15NO
MolecularWeight: 201.2643
MdlNumber: MFCD04973732
Smiles: OCc1ccc(cc1)n1c(C)ccc1C
Complexity: 189
Covalently-bondedUnitCount: 1
HeavyAtomCount: 15
HydrogenBondAcceptorCount: 1
HydrogenBondDonorCount: 1
RotatableBondCount: 2
Xlogp3: 2.2
CatalogNumber:
AE02835
ChemicalName:
4-(2,5-Dimethylpyrrol-1-yl)benzyl alcohol
CasNumber:
773870-17-0
MolecularFormula:
C13H15NO
MolecularWeight:
201.2643
MdlNumber:
MFCD04973732
Smiles:
OCc1ccc(cc1)n1c(C)ccc1C
Complexity:
189
Covalently-bondedUnitCount:
1
HeavyAtomCount:
15
HydrogenBondAcceptorCount:
1
HydrogenBondDonorCount:
1
RotatableBondCount:
2
Xlogp3:
2.2
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Smiles: OC(=O)c1ccc(o1)c1cccc(c1)S(=O)(=O)N
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
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Smiles:
OC(=O)c1ccc(o1)c1cccc(c1)S(=O)(=O)N
Complexity:
__
Covalently-bondedUnitCount:
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HeavyAtomCount:
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HydrogenBondAcceptorCount:
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RotatableBondCount:
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Smiles: OCc1cccn1Cc1ccccc1[N+](=O)[O-]
Complexity: __
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Smiles:
OCc1cccn1Cc1ccccc1[N+](=O)[O-]
Complexity:
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HeavyAtomCount:
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HydrogenBondAcceptorCount:
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HydrogenBondDonorCount:
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RotatableBondCount:
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Smiles: Clc1nc2ccccc2cc1C1(O)CCN(CC1)Cc1ccccc1
Complexity: __
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HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
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ChemicalName:
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CasNumber:
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MolecularFormula:
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MolecularWeight:
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MdlNumber:
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Smiles:
Clc1nc2ccccc2cc1C1(O)CCN(CC1)Cc1ccccc1
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
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