AB44192
3958-60-9 | 2-Nitrobenzyl bromide
Manufacturer: A2B Chem
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CatalogNumber
AB44192
ChemicalName
2-Nitrobenzyl bromide
CasNumber
3958-60-9
MolecularFormula
C7H6BrNO2
MolecularWeight
216.032
MdlNumber
MFCD00007184
Smiles
BrCc1ccccc1N(=O)=O
NscNumber
95415
Complexity
146
Covalently-bondedUnitCount
1
HeavyAtomCount
11
HydrogenBondAcceptorCount
2
RotatableBondCount
1
Xlogp3
2.7
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CatalogNumber: AB44192
ChemicalName: 2-Nitrobenzyl bromide
CasNumber: 3958-60-9
MolecularFormula: C7H6BrNO2
MolecularWeight: 216.032
MdlNumber: MFCD00007184
Smiles: BrCc1ccccc1N(=O)=O
NscNumber: 95415
Complexity: 146
Covalently-bondedUnitCount: 1
HeavyAtomCount: 11
HydrogenBondAcceptorCount: 2
RotatableBondCount: 1
Xlogp3: 2.7
CatalogNumber:
AB44192
ChemicalName:
2-Nitrobenzyl bromide
CasNumber:
3958-60-9
MolecularFormula:
C7H6BrNO2
MolecularWeight:
216.032
MdlNumber:
MFCD00007184
Smiles:
BrCc1ccccc1N(=O)=O
NscNumber:
95415
Complexity:
146
Covalently-bondedUnitCount:
1
HeavyAtomCount:
11
HydrogenBondAcceptorCount:
2
RotatableBondCount:
1
Xlogp3:
2.7
CatalogNumber: AB44193
ChemicalName: 2-Nitroethanol
CasNumber: 625-48-9
MolecularFormula: C2H5NO3
MolecularWeight: 91.066
MdlNumber: MFCD00007405
Smiles: OCCN(=O)=O
NscNumber: 16151
Complexity: 47.2
Covalently-bondedUnitCount: 1
HeavyAtomCount: 6
HydrogenBondAcceptorCount: 3
RotatableBondCount: 1
Xlogp3: -0.4
CatalogNumber:
AB44193
ChemicalName:
2-Nitroethanol
CasNumber:
625-48-9
MolecularFormula:
C2H5NO3
MolecularWeight:
91.066
MdlNumber:
MFCD00007405
Smiles:
OCCN(=O)=O
NscNumber:
16151
Complexity:
47.2
Covalently-bondedUnitCount:
1
HeavyAtomCount:
6
HydrogenBondAcceptorCount:
3
RotatableBondCount:
1
Xlogp3:
-0.4
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: [O-][N+](=O)c1ccccc1Sc1ccccc1
NscNumber: __
Complexity: 236
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: 3.8
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
[O-][N+](=O)c1ccccc1Sc1ccccc1
NscNumber:
__
Complexity:
236
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
3.8
CatalogNumber: AB44196
ChemicalName: 2-Nitroresorcinol
CasNumber: 601-89-8
MolecularFormula: C6H5NO4
MolecularWeight: 155.1082
MdlNumber: MFCD00007124
Smiles: [O-][N+](=O)c1c(O)cccc1O
NscNumber: 1542
Complexity: 145
Covalently-bondedUnitCount: 1
HeavyAtomCount: 11
HydrogenBondAcceptorCount: 4
RotatableBondCount: __
Xlogp3: 1.6
CatalogNumber:
AB44196
ChemicalName:
2-Nitroresorcinol
CasNumber:
601-89-8
MolecularFormula:
C6H5NO4
MolecularWeight:
155.1082
MdlNumber:
MFCD00007124
Smiles:
[O-][N+](=O)c1c(O)cccc1O
NscNumber:
1542
Complexity:
145
Covalently-bondedUnitCount:
1
HeavyAtomCount:
11
HydrogenBondAcceptorCount:
4
RotatableBondCount:
__
Xlogp3:
1.6