AI01577
65235-31-6 | N-(2-Hydroxyethyl) 4-hydroxy-2-nitroaniline
Manufacturer: A2B Chem
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CatalogNumber
AI01577
ChemicalName
N-(2-Hydroxyethyl) 4-hydroxy-2-nitroaniline
CasNumber
65235-31-6
MolecularFormula
C8H10N2O4
MolecularWeight
198.176
MdlNumber
MFCD02684022
Smiles
OCCNc1ccc(cc1[N+](=O)[O-])O
Complexity
194
Covalently-bondedUnitCount
1
HeavyAtomCount
14
HydrogenBondAcceptorCount
5
HydrogenBondDonorCount
3
RotatableBondCount
3
Xlogp3
1.3
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CatalogNumber: AI01577
ChemicalName: N-(2-Hydroxyethyl) 4-hydroxy-2-nitroaniline
CasNumber: 65235-31-6
MolecularFormula: C8H10N2O4
MolecularWeight: 198.176
MdlNumber: MFCD02684022
Smiles: OCCNc1ccc(cc1[N+](=O)[O-])O
Complexity: 194
Covalently-bondedUnitCount: 1
HeavyAtomCount: 14
HydrogenBondAcceptorCount: 5
HydrogenBondDonorCount: 3
RotatableBondCount: 3
Xlogp3: 1.3
CatalogNumber:
AI01577
ChemicalName:
N-(2-Hydroxyethyl) 4-hydroxy-2-nitroaniline
CasNumber:
65235-31-6
MolecularFormula:
C8H10N2O4
MolecularWeight:
198.176
MdlNumber:
MFCD02684022
Smiles:
OCCNc1ccc(cc1[N+](=O)[O-])O
Complexity:
194
Covalently-bondedUnitCount:
1
HeavyAtomCount:
14
HydrogenBondAcceptorCount:
5
HydrogenBondDonorCount:
3
RotatableBondCount:
3
Xlogp3:
1.3
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: Fc1c(O)c(F)c(c(c1F)C(=O)O)F
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
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CasNumber:
__
MolecularFormula:
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MolecularWeight:
__
MdlNumber:
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Smiles:
Fc1c(O)c(F)c(c(c1F)C(=O)O)F
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: AI01583
ChemicalName: 3-hydroxy-5-(hydroxymethyl)-2-methylpyridine-4-carbaldehyde hydrochloride
CasNumber: 65-22-5
MolecularFormula: C8H10ClNO3
MolecularWeight: 203.6229
MdlNumber: MFCD00012809
Smiles: O=Cc1c(CO)cnc(c1O)C.Cl
Complexity: 162
Covalently-bondedUnitCount: 2
HeavyAtomCount: 13
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: 3
RotatableBondCount: 2
Xlogp3: __
CatalogNumber:
AI01583
ChemicalName:
3-hydroxy-5-(hydroxymethyl)-2-methylpyridine-4-carbaldehyde hydrochloride
CasNumber:
65-22-5
MolecularFormula:
C8H10ClNO3
MolecularWeight:
203.6229
MdlNumber:
MFCD00012809
Smiles:
O=Cc1c(CO)cnc(c1O)C.Cl
Complexity:
162
Covalently-bondedUnitCount:
2
HeavyAtomCount:
13
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
3
RotatableBondCount:
2
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: CC(C(=O)NC1(CCCCC1)C(=O)O)C
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
CC(C(=O)NC1(CCCCC1)C(=O)O)C
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__