AG32811
5435-92-7 | 2-Chloro-4-phenylbenzonitrile
Manufacturer: A2B Chem
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CatalogNumber
AG32811
ChemicalName
2-Chloro-4-phenylbenzonitrile
CasNumber
5435-92-7
MolecularFormula
C13H8ClN
MolecularWeight
213.6623
MdlNumber
MFCD14701624
Smiles
N#Cc1ccc(cc1Cl)c1ccccc1
NscNumber
21381
Complexity
249
Covalently-bondedUnitCount
1
HeavyAtomCount
15
HydrogenBondAcceptorCount
1
RotatableBondCount
1
Xlogp3
4.4
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CatalogNumber: AG32811
ChemicalName: 2-Chloro-4-phenylbenzonitrile
CasNumber: 5435-92-7
MolecularFormula: C13H8ClN
MolecularWeight: 213.6623
MdlNumber: MFCD14701624
Smiles: N#Cc1ccc(cc1Cl)c1ccccc1
NscNumber: 21381
Complexity: 249
Covalently-bondedUnitCount: 1
HeavyAtomCount: 15
HydrogenBondAcceptorCount: 1
RotatableBondCount: 1
Xlogp3: 4.4
CatalogNumber:
AG32811
ChemicalName:
2-Chloro-4-phenylbenzonitrile
CasNumber:
5435-92-7
MolecularFormula:
C13H8ClN
MolecularWeight:
213.6623
MdlNumber:
MFCD14701624
Smiles:
N#Cc1ccc(cc1Cl)c1ccccc1
NscNumber:
21381
Complexity:
249
Covalently-bondedUnitCount:
1
HeavyAtomCount:
15
HydrogenBondAcceptorCount:
1
RotatableBondCount:
1
Xlogp3:
4.4
CatalogNumber: AG32812
ChemicalName: 2-(3-Chloro-4-methylphenyl)benzonitrile
CasNumber: 442670-45-3
MolecularFormula: C14H10ClN
MolecularWeight: 227.6889
MdlNumber: MFCD07779319
Smiles: N#Cc1ccccc1c1ccc(c(c1)Cl)C
NscNumber: __
Complexity: 280
Covalently-bondedUnitCount: 1
HeavyAtomCount: 16
HydrogenBondAcceptorCount: 1
RotatableBondCount: 1
Xlogp3: 4.3
CatalogNumber:
AG32812
ChemicalName:
2-(3-Chloro-4-methylphenyl)benzonitrile
CasNumber:
442670-45-3
MolecularFormula:
C14H10ClN
MolecularWeight:
227.6889
MdlNumber:
MFCD07779319
Smiles:
N#Cc1ccccc1c1ccc(c(c1)Cl)C
NscNumber:
__
Complexity:
280
Covalently-bondedUnitCount:
1
HeavyAtomCount:
16
HydrogenBondAcceptorCount:
1
RotatableBondCount:
1
Xlogp3:
4.3
CatalogNumber: AG32813
ChemicalName: 4-(2-Methylpropoxy)benzonitrile
CasNumber: 5203-15-6
MolecularFormula: C11H13NO
MolecularWeight: 175.227
MdlNumber: MFCD08274895
Smiles: CC(COc1ccc(cc1)C#N)C
NscNumber: __
Complexity: 184
Covalently-bondedUnitCount: 1
HeavyAtomCount: 13
HydrogenBondAcceptorCount: 2
RotatableBondCount: 3
Xlogp3: 2.9
CatalogNumber:
AG32813
ChemicalName:
4-(2-Methylpropoxy)benzonitrile
CasNumber:
5203-15-6
MolecularFormula:
C11H13NO
MolecularWeight:
175.227
MdlNumber:
MFCD08274895
Smiles:
CC(COc1ccc(cc1)C#N)C
NscNumber:
__
Complexity:
184
Covalently-bondedUnitCount:
1
HeavyAtomCount:
13
HydrogenBondAcceptorCount:
2
RotatableBondCount:
3
Xlogp3:
2.9
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: COc1c(C)cccc1Br
NscNumber: __
Complexity: 105
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: 2.8
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
COc1c(C)cccc1Br
NscNumber:
__
Complexity:
105
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
2.8