AB65937
874-86-2 | 4-(Chloromethyl)benzonitrile
Manufacturer: A2B Chem
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CatalogNumber
AB65937
ChemicalName
4-(Chloromethyl)benzonitrile
CasNumber
874-86-2
MolecularFormula
C8H6ClN
MolecularWeight
151.59294
MdlNumber
MFCD00015443
Smiles
ClCc1ccc(cc1)C#N
Complexity
139
Covalently-bondedUnitCount
1
HeavyAtomCount
10
HydrogenBondAcceptorCount
1
RotatableBondCount
1
Xlogp3
2
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CatalogNumber: AB65937
ChemicalName: 4-(Chloromethyl)benzonitrile
CasNumber: 874-86-2
MolecularFormula: C8H6ClN
MolecularWeight: 151.59294
MdlNumber: MFCD00015443
Smiles: ClCc1ccc(cc1)C#N
Complexity: 139
Covalently-bondedUnitCount: 1
HeavyAtomCount: 10
HydrogenBondAcceptorCount: 1
RotatableBondCount: 1
Xlogp3: 2
CatalogNumber:
AB65937
ChemicalName:
4-(Chloromethyl)benzonitrile
CasNumber:
874-86-2
MolecularFormula:
C8H6ClN
MolecularWeight:
151.59294
MdlNumber:
MFCD00015443
Smiles:
ClCc1ccc(cc1)C#N
Complexity:
139
Covalently-bondedUnitCount:
1
HeavyAtomCount:
10
HydrogenBondAcceptorCount:
1
RotatableBondCount:
1
Xlogp3:
2
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: O=C=Nc1ccc(cc1)S(=O)(=O)Cl
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
O=C=Nc1ccc(cc1)S(=O)(=O)Cl
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: AB65939
ChemicalName: 4-(Cyanomethyl)-2-methoxyphenyl acetate
CasNumber: 5438-51-7
MolecularFormula: C11H11NO3
MolecularWeight: 205.2099
MdlNumber: MFCD22421594
Smiles: N#CCc1ccc(c(c1)OC)OC(=O)C
Complexity: 268
Covalently-bondedUnitCount: 1
HeavyAtomCount: 15
HydrogenBondAcceptorCount: 4
RotatableBondCount: 4
Xlogp3: 0.9
CatalogNumber:
AB65939
ChemicalName:
4-(Cyanomethyl)-2-methoxyphenyl acetate
CasNumber:
5438-51-7
MolecularFormula:
C11H11NO3
MolecularWeight:
205.2099
MdlNumber:
MFCD22421594
Smiles:
N#CCc1ccc(c(c1)OC)OC(=O)C
Complexity:
268
Covalently-bondedUnitCount:
1
HeavyAtomCount:
15
HydrogenBondAcceptorCount:
4
RotatableBondCount:
4
Xlogp3:
0.9
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: COc1ccc(cc1)S(=O)(=O)N1CCN(CC1)C(c1nc(OC2CCCCC2)c2c(n1)cccc2)C
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
COc1ccc(cc1)S(=O)(=O)N1CCN(CC1)C(c1nc(OC2CCCCC2)c2c(n1)cccc2)C
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__