AE61940
1352318-70-7 | 4-(4-Chloro-2-methoxyphenyl)benzonitrile
Manufacturer: A2B Chem
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CatalogNumber
AE61940
ChemicalName
4-(4-Chloro-2-methoxyphenyl)benzonitrile
CasNumber
1352318-70-7
MolecularFormula
C14H10ClNO
MolecularWeight
243.6883
MdlNumber
MFCD20529468
Smiles
COc1cc(Cl)ccc1c1ccc(cc1)C#N
Complexity
290
Covalently-bondedUnitCount
1
HeavyAtomCount
17
HydrogenBondAcceptorCount
2
RotatableBondCount
2
Xlogp3
4.1
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CatalogNumber: AE61940
ChemicalName: 4-(4-Chloro-2-methoxyphenyl)benzonitrile
CasNumber: 1352318-70-7
MolecularFormula: C14H10ClNO
MolecularWeight: 243.6883
MdlNumber: MFCD20529468
Smiles: COc1cc(Cl)ccc1c1ccc(cc1)C#N
Complexity: 290
Covalently-bondedUnitCount: 1
HeavyAtomCount: 17
HydrogenBondAcceptorCount: 2
RotatableBondCount: 2
Xlogp3: 4.1
CatalogNumber:
AE61940
ChemicalName:
4-(4-Chloro-2-methoxyphenyl)benzonitrile
CasNumber:
1352318-70-7
MolecularFormula:
C14H10ClNO
MolecularWeight:
243.6883
MdlNumber:
MFCD20529468
Smiles:
COc1cc(Cl)ccc1c1ccc(cc1)C#N
Complexity:
290
Covalently-bondedUnitCount:
1
HeavyAtomCount:
17
HydrogenBondAcceptorCount:
2
RotatableBondCount:
2
Xlogp3:
4.1
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: Fc1ccc(c(c1)NC1CCCCC1)[N+](=O)[O-]
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
Fc1ccc(c(c1)NC1CCCCC1)[N+](=O)[O-]
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: AE61942
ChemicalName: 3-Carboxymethyl-3'-(dimethylaminocarbonyl)biphenyl
CasNumber: 1375068-92-0
MolecularFormula: C17H17NO3
MolecularWeight: 283.3218
MdlNumber: MFCD22205796
Smiles: OC(=O)Cc1cccc(c1)c1cccc(c1)C(=O)N(C)C
Complexity: 380
Covalently-bondedUnitCount: 1
HeavyAtomCount: 21
HydrogenBondAcceptorCount: 3
RotatableBondCount: 4
Xlogp3: 2.5
CatalogNumber:
AE61942
ChemicalName:
3-Carboxymethyl-3'-(dimethylaminocarbonyl)biphenyl
CasNumber:
1375068-92-0
MolecularFormula:
C17H17NO3
MolecularWeight:
283.3218
MdlNumber:
MFCD22205796
Smiles:
OC(=O)Cc1cccc(c1)c1cccc(c1)C(=O)N(C)C
Complexity:
380
Covalently-bondedUnitCount:
1
HeavyAtomCount:
21
HydrogenBondAcceptorCount:
3
RotatableBondCount:
4
Xlogp3:
2.5
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: COc1ccc(cc1)c1ccc(c(c1)Cl)C
Complexity: 211
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: 4.5
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
COc1ccc(cc1)c1ccc(c(c1)Cl)C
Complexity:
211
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
4.5