AB77601
10439-77-7 | N-Methyl-4-nitro-o-toluidine
Manufacturer: A2B Chem
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CatalogNumber
AB77601
ChemicalName
N-Methyl-4-nitro-o-toluidine
CasNumber
10439-77-7
MolecularFormula
C8H10N2O2
MolecularWeight
166.1772
MdlNumber
MFCD00059083
Smiles
CNc1ccc(cc1C)[N+](=O)[O-]
Complexity
167
Covalently-bondedUnitCount
1
HeavyAtomCount
12
HydrogenBondAcceptorCount
3
HydrogenBondDonorCount
1
RotatableBondCount
1
Xlogp3
2.7
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CatalogNumber: AB77601
ChemicalName: N-Methyl-4-nitro-o-toluidine
CasNumber: 10439-77-7
MolecularFormula: C8H10N2O2
MolecularWeight: 166.1772
MdlNumber: MFCD00059083
Smiles: CNc1ccc(cc1C)[N+](=O)[O-]
Complexity: 167
Covalently-bondedUnitCount: 1
HeavyAtomCount: 12
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: 1
RotatableBondCount: 1
Xlogp3: 2.7
CatalogNumber:
AB77601
ChemicalName:
N-Methyl-4-nitro-o-toluidine
CasNumber:
10439-77-7
MolecularFormula:
C8H10N2O2
MolecularWeight:
166.1772
MdlNumber:
MFCD00059083
Smiles:
CNc1ccc(cc1C)[N+](=O)[O-]
Complexity:
167
Covalently-bondedUnitCount:
1
HeavyAtomCount:
12
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
1
RotatableBondCount:
1
Xlogp3:
2.7
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: CNCc1ccc(cc1)Oc1ccccc1
Complexity: 181
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: 2.8
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
CNCc1ccc(cc1)Oc1ccccc1
Complexity:
181
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
2.8
CatalogNumber: AB77603
ChemicalName: 4-Hydroxy-1-methylpiperidine
CasNumber: 106-52-5
MolecularFormula: C6H13NO
MolecularWeight: 115.17352
MdlNumber: MFCD00006500
Smiles: CN1CCC(CC1)O
Complexity: 66.9
Covalently-bondedUnitCount: 1
HeavyAtomCount: 8
HydrogenBondAcceptorCount: 2
HydrogenBondDonorCount: 1
RotatableBondCount: __
Xlogp3: 0.1
CatalogNumber:
AB77603
ChemicalName:
4-Hydroxy-1-methylpiperidine
CasNumber:
106-52-5
MolecularFormula:
C6H13NO
MolecularWeight:
115.17352
MdlNumber:
MFCD00006500
Smiles:
CN1CCC(CC1)O
Complexity:
66.9
Covalently-bondedUnitCount:
1
HeavyAtomCount:
8
HydrogenBondAcceptorCount:
2
HydrogenBondDonorCount:
1
RotatableBondCount:
__
Xlogp3:
0.1
CatalogNumber: AB77604
ChemicalName: 2-(N-Methylaminocarbonyl)pyridine-5-boronic acid pinacol ester
CasNumber: 945863-21-8
MolecularFormula: C13H19BN2O3
MolecularWeight: 262.1126
MdlNumber: MFCD08458483
Smiles: CNC(=O)c1ccc(cn1)B1OC(C(O1)(C)C)(C)C
Complexity: 344
Covalently-bondedUnitCount: 1
HeavyAtomCount: 19
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: 1
RotatableBondCount: 2
Xlogp3: __
CatalogNumber:
AB77604
ChemicalName:
2-(N-Methylaminocarbonyl)pyridine-5-boronic acid pinacol ester
CasNumber:
945863-21-8
MolecularFormula:
C13H19BN2O3
MolecularWeight:
262.1126
MdlNumber:
MFCD08458483
Smiles:
CNC(=O)c1ccc(cn1)B1OC(C(O1)(C)C)(C)C
Complexity:
344
Covalently-bondedUnitCount:
1
HeavyAtomCount:
19
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
1
RotatableBondCount:
2
Xlogp3:
__