AB45112
18600-42-5 | 4-Nitrobenzylamine HCl
Manufacturer: A2B Chem
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CatalogNumber
AB45112
ChemicalName
4-Nitrobenzylamine HCl
CasNumber
18600-42-5
MolecularFormula
C7H9ClN2O2
MolecularWeight
188.6116
MdlNumber
MFCD00012863
Smiles
NCc1ccc(cc1)[N+](=O)[O-].Cl
Complexity
136
Covalently-bondedUnitCount
2
HeavyAtomCount
12
HydrogenBondAcceptorCount
3
HydrogenBondDonorCount
2
RotatableBondCount
1
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CatalogNumber: AB45112
ChemicalName: 4-Nitrobenzylamine HCl
CasNumber: 18600-42-5
MolecularFormula: C7H9ClN2O2
MolecularWeight: 188.6116
MdlNumber: MFCD00012863
Smiles: NCc1ccc(cc1)[N+](=O)[O-].Cl
Complexity: 136
Covalently-bondedUnitCount: 2
HeavyAtomCount: 12
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: 2
RotatableBondCount: 1
CatalogNumber:
AB45112
ChemicalName:
4-Nitrobenzylamine HCl
CasNumber:
18600-42-5
MolecularFormula:
C7H9ClN2O2
MolecularWeight:
188.6116
MdlNumber:
MFCD00012863
Smiles:
NCc1ccc(cc1)[N+](=O)[O-].Cl
Complexity:
136
Covalently-bondedUnitCount:
2
HeavyAtomCount:
12
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
2
RotatableBondCount:
1
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: Brc1ccc(cc1)N(=O)=O
Complexity: 126
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
Brc1ccc(cc1)N(=O)=O
Complexity:
126
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
CatalogNumber: AB45114
ChemicalName: 4-Nitrocatechol
CasNumber: 3316-09-4
MolecularFormula: C6H5NO4
MolecularWeight: 155.1082
MdlNumber: MFCD00007242
Smiles: [O-][N+](=O)c1ccc(c(c1)O)O
Complexity: 155
Covalently-bondedUnitCount: 1
HeavyAtomCount: 11
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: 2
RotatableBondCount: __
CatalogNumber:
AB45114
ChemicalName:
4-Nitrocatechol
CasNumber:
3316-09-4
MolecularFormula:
C6H5NO4
MolecularWeight:
155.1082
MdlNumber:
MFCD00007242
Smiles:
[O-][N+](=O)c1ccc(c(c1)O)O
Complexity:
155
Covalently-bondedUnitCount:
1
HeavyAtomCount:
11
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
2
RotatableBondCount:
__
CatalogNumber: AB45115
ChemicalName: 4-Nitroindole
CasNumber: 4769-97-5
MolecularFormula: C8H6N2O2
MolecularWeight: 162.1454
MdlNumber: MFCD00010056
Smiles: [O-][N+](=O)c1cccc2c1cc[nH]2
Complexity: 190
Covalently-bondedUnitCount: 1
HeavyAtomCount: 12
HydrogenBondAcceptorCount: 2
HydrogenBondDonorCount: 1
RotatableBondCount: __
CatalogNumber:
AB45115
ChemicalName:
4-Nitroindole
CasNumber:
4769-97-5
MolecularFormula:
C8H6N2O2
MolecularWeight:
162.1454
MdlNumber:
MFCD00010056
Smiles:
[O-][N+](=O)c1cccc2c1cc[nH]2
Complexity:
190
Covalently-bondedUnitCount:
1
HeavyAtomCount:
12
HydrogenBondAcceptorCount:
2
HydrogenBondDonorCount:
1
RotatableBondCount:
__