AD11980
89900-95-8 | Methyl 4-(4-cyanophenyl)benzoate
Manufacturer: A2B Chem
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CatalogNumber
AD11980
ChemicalName
Methyl 4-(4-cyanophenyl)benzoate
CasNumber
89900-95-8
MolecularFormula
C15H11NO2
MolecularWeight
237.2533
MdlNumber
MFCD03791240
Smiles
COC(=O)c1ccc(cc1)c1ccc(cc1)C#N
Complexity
328
Covalently-bondedUnitCount
1
HeavyAtomCount
18
HydrogenBondAcceptorCount
3
RotatableBondCount
3
Xlogp3
3.7
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CatalogNumber: AD11980
ChemicalName: Methyl 4-(4-cyanophenyl)benzoate
CasNumber: 89900-95-8
MolecularFormula: C15H11NO2
MolecularWeight: 237.2533
MdlNumber: MFCD03791240
Smiles: COC(=O)c1ccc(cc1)c1ccc(cc1)C#N
Complexity: 328
Covalently-bondedUnitCount: 1
HeavyAtomCount: 18
HydrogenBondAcceptorCount: 3
RotatableBondCount: 3
Xlogp3: 3.7
CatalogNumber:
AD11980
ChemicalName:
Methyl 4-(4-cyanophenyl)benzoate
CasNumber:
89900-95-8
MolecularFormula:
C15H11NO2
MolecularWeight:
237.2533
MdlNumber:
MFCD03791240
Smiles:
COC(=O)c1ccc(cc1)c1ccc(cc1)C#N
Complexity:
328
Covalently-bondedUnitCount:
1
HeavyAtomCount:
18
HydrogenBondAcceptorCount:
3
RotatableBondCount:
3
Xlogp3:
3.7
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: Clc1ccc(cc1)c1snc(n1)N
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
Clc1ccc(cc1)c1snc(n1)N
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: BrCC1CC(C1)C(=O)OC
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
BrCC1CC(C1)C(=O)OC
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: AD11996
ChemicalName: 7-Bromoquinazoline
CasNumber: 89892-22-8
MolecularFormula: C8H5BrN2
MolecularWeight: 209.0427
MdlNumber: MFCD07778500
Smiles: Brc1ccc2c(c1)ncnc2
Complexity: 140
Covalently-bondedUnitCount: 1
HeavyAtomCount: 11
HydrogenBondAcceptorCount: 2
RotatableBondCount: __
Xlogp3: 1.8
CatalogNumber:
AD11996
ChemicalName:
7-Bromoquinazoline
CasNumber:
89892-22-8
MolecularFormula:
C8H5BrN2
MolecularWeight:
209.0427
MdlNumber:
MFCD07778500
Smiles:
Brc1ccc2c(c1)ncnc2
Complexity:
140
Covalently-bondedUnitCount:
1
HeavyAtomCount:
11
HydrogenBondAcceptorCount:
2
RotatableBondCount:
__
Xlogp3:
1.8