AD62660
19370-33-3 | 1-(2-Methylpropyl)-2-nitrobenzene
Manufacturer: A2B Chem
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CatalogNumber
AD62660
ChemicalName
1-(2-Methylpropyl)-2-nitrobenzene
CasNumber
19370-33-3
MolecularFormula
C10H13NO2
MolecularWeight
179.2157
MdlNumber
MFCD00130031
Smiles
CC(Cc1ccccc1[N+](=O)[O-])C
Complexity
174
Covalently-bondedUnitCount
1
HeavyAtomCount
13
HydrogenBondAcceptorCount
2
RotatableBondCount
2
UndefinedAtomStereocenterCount
1
Xlogp3
3.5
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CatalogNumber: AD62660
ChemicalName: 1-(2-Methylpropyl)-2-nitrobenzene
CasNumber: 19370-33-3
MolecularFormula: C10H13NO2
MolecularWeight: 179.2157
MdlNumber: MFCD00130031
Smiles: CC(Cc1ccccc1[N+](=O)[O-])C
Complexity: 174
Covalently-bondedUnitCount: 1
HeavyAtomCount: 13
HydrogenBondAcceptorCount: 2
RotatableBondCount: 2
UndefinedAtomStereocenterCount: 1
Xlogp3: 3.5
CatalogNumber:
AD62660
ChemicalName:
1-(2-Methylpropyl)-2-nitrobenzene
CasNumber:
19370-33-3
MolecularFormula:
C10H13NO2
MolecularWeight:
179.2157
MdlNumber:
MFCD00130031
Smiles:
CC(Cc1ccccc1[N+](=O)[O-])C
Complexity:
174
Covalently-bondedUnitCount:
1
HeavyAtomCount:
13
HydrogenBondAcceptorCount:
2
RotatableBondCount:
2
UndefinedAtomStereocenterCount:
1
Xlogp3:
3.5
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Smiles: FC(C(F)(F)F)(c1cc[nH]n1)F
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Smiles:
FC(C(F)(F)F)(c1cc[nH]n1)F
Complexity:
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__
HydrogenBondAcceptorCount:
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Smiles: CCc1ccccc1C(=N)N
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Smiles:
CCc1ccccc1C(=N)N
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HydrogenBondAcceptorCount:
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RotatableBondCount:
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UndefinedAtomStereocenterCount:
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Smiles: O=c1[nH]c(=O)c2-c(n1)[nH][nH]c2
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Smiles:
O=c1[nH]c(=O)c2-c(n1)[nH][nH]c2
Complexity:
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Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
UndefinedAtomStereocenterCount:
__
Xlogp3:
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