AB14114
192699-67-5 | 3-(3-Nitrophenyl)benzonitrile
Manufacturer: A2B Chem
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CatalogNumber
AB14114
ChemicalName
3-(3-Nitrophenyl)benzonitrile
CasNumber
192699-67-5
MolecularFormula
C13H8N2O2
MolecularWeight
224.2148
MdlNumber
MFCD06803024
Smiles
N#Cc1cccc(c1)c1cccc(c1)[N+](=O)[O-]
Complexity
328
Covalently-bondedUnitCount
1
HeavyAtomCount
17
HydrogenBondAcceptorCount
3
RotatableBondCount
1
Xlogp3
3.6
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CatalogNumber: AB14114
ChemicalName: 3-(3-Nitrophenyl)benzonitrile
CasNumber: 192699-67-5
MolecularFormula: C13H8N2O2
MolecularWeight: 224.2148
MdlNumber: MFCD06803024
Smiles: N#Cc1cccc(c1)c1cccc(c1)[N+](=O)[O-]
Complexity: 328
Covalently-bondedUnitCount: 1
HeavyAtomCount: 17
HydrogenBondAcceptorCount: 3
RotatableBondCount: 1
Xlogp3: 3.6
CatalogNumber:
AB14114
ChemicalName:
3-(3-Nitrophenyl)benzonitrile
CasNumber:
192699-67-5
MolecularFormula:
C13H8N2O2
MolecularWeight:
224.2148
MdlNumber:
MFCD06803024
Smiles:
N#Cc1cccc(c1)c1cccc(c1)[N+](=O)[O-]
Complexity:
328
Covalently-bondedUnitCount:
1
HeavyAtomCount:
17
HydrogenBondAcceptorCount:
3
RotatableBondCount:
1
Xlogp3:
3.6
CatalogNumber: AB14115
ChemicalName: 4-(4-tert-Butylphenyl)benzonitrile
CasNumber: 192699-51-7
MolecularFormula: C17H17N
MolecularWeight: 235.3236
MdlNumber: MFCD06802641
Smiles: N#Cc1ccc(cc1)c1ccc(cc1)C(C)(C)C
Complexity: 300
Covalently-bondedUnitCount: 1
HeavyAtomCount: 18
HydrogenBondAcceptorCount: 1
RotatableBondCount: 2
Xlogp3: 4.9
CatalogNumber:
AB14115
ChemicalName:
4-(4-tert-Butylphenyl)benzonitrile
CasNumber:
192699-51-7
MolecularFormula:
C17H17N
MolecularWeight:
235.3236
MdlNumber:
MFCD06802641
Smiles:
N#Cc1ccc(cc1)c1ccc(cc1)C(C)(C)C
Complexity:
300
Covalently-bondedUnitCount:
1
HeavyAtomCount:
18
HydrogenBondAcceptorCount:
1
RotatableBondCount:
2
Xlogp3:
4.9
CatalogNumber: AB14116
ChemicalName: 3-(4-t-Butylphenyl)benzonitrile
CasNumber: 192699-50-6
MolecularFormula: C17H17N
MolecularWeight: 235.3236
MdlNumber: MFCD06802642
Smiles: N#Cc1cccc(c1)c1ccc(cc1)C(C)(C)C
Complexity: 308
Covalently-bondedUnitCount: 1
HeavyAtomCount: 18
HydrogenBondAcceptorCount: 1
RotatableBondCount: 2
Xlogp3: 4.9
CatalogNumber:
AB14116
ChemicalName:
3-(4-t-Butylphenyl)benzonitrile
CasNumber:
192699-50-6
MolecularFormula:
C17H17N
MolecularWeight:
235.3236
MdlNumber:
MFCD06802642
Smiles:
N#Cc1cccc(c1)c1ccc(cc1)C(C)(C)C
Complexity:
308
Covalently-bondedUnitCount:
1
HeavyAtomCount:
18
HydrogenBondAcceptorCount:
1
RotatableBondCount:
2
Xlogp3:
4.9
CatalogNumber: AB14117
ChemicalName: 2-(4-tert-Butylphenyl)benzonitrile
CasNumber: 192699-49-3
MolecularFormula: C17H17N
MolecularWeight: 235.3236
MdlNumber: MFCD06802647
Smiles: N#Cc1ccccc1c1ccc(cc1)C(C)(C)C
Complexity: 308
Covalently-bondedUnitCount: 1
HeavyAtomCount: 18
HydrogenBondAcceptorCount: 1
RotatableBondCount: 2
Xlogp3: 4.9
CatalogNumber:
AB14117
ChemicalName:
2-(4-tert-Butylphenyl)benzonitrile
CasNumber:
192699-49-3
MolecularFormula:
C17H17N
MolecularWeight:
235.3236
MdlNumber:
MFCD06802647
Smiles:
N#Cc1ccccc1c1ccc(cc1)C(C)(C)C
Complexity:
308
Covalently-bondedUnitCount:
1
HeavyAtomCount:
18
HydrogenBondAcceptorCount:
1
RotatableBondCount:
2
Xlogp3:
4.9