AB44930
872091-83-3 | Methyl 4-chloro-3-(cyanomethyl)benzoate
Manufacturer: A2B Chem
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CatalogNumber
AB44930
ChemicalName
Methyl 4-chloro-3-(cyanomethyl)benzoate
CasNumber
872091-83-3
MolecularFormula
C10H8ClNO2
MolecularWeight
209.629
MdlNumber
MFCD09263465
Smiles
N#CCc1cc(ccc1Cl)C(=O)OC
Complexity
258
Covalently-bondedUnitCount
1
HeavyAtomCount
14
HydrogenBondAcceptorCount
3
RotatableBondCount
3
Xlogp3
2.1
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CatalogNumber: AB44930
ChemicalName: Methyl 4-chloro-3-(cyanomethyl)benzoate
CasNumber: 872091-83-3
MolecularFormula: C10H8ClNO2
MolecularWeight: 209.629
MdlNumber: MFCD09263465
Smiles: N#CCc1cc(ccc1Cl)C(=O)OC
Complexity: 258
Covalently-bondedUnitCount: 1
HeavyAtomCount: 14
HydrogenBondAcceptorCount: 3
RotatableBondCount: 3
Xlogp3: 2.1
CatalogNumber:
AB44930
ChemicalName:
Methyl 4-chloro-3-(cyanomethyl)benzoate
CasNumber:
872091-83-3
MolecularFormula:
C10H8ClNO2
MolecularWeight:
209.629
MdlNumber:
MFCD09263465
Smiles:
N#CCc1cc(ccc1Cl)C(=O)OC
Complexity:
258
Covalently-bondedUnitCount:
1
HeavyAtomCount:
14
HydrogenBondAcceptorCount:
3
RotatableBondCount:
3
Xlogp3:
2.1
CatalogNumber: AB44931
ChemicalName: 4'-Chloro-3'-fluoroacetophenone
CasNumber: 151945-84-5
MolecularFormula: C8H6ClFO
MolecularWeight: 172.584
MdlNumber: MFCD04115858
Smiles: CC(=O)c1ccc(c(c1)F)Cl
Complexity: 160
Covalently-bondedUnitCount: 1
HeavyAtomCount: 11
HydrogenBondAcceptorCount: 2
RotatableBondCount: 1
Xlogp3: 2.3
CatalogNumber:
AB44931
ChemicalName:
4'-Chloro-3'-fluoroacetophenone
CasNumber:
151945-84-5
MolecularFormula:
C8H6ClFO
MolecularWeight:
172.584
MdlNumber:
MFCD04115858
Smiles:
CC(=O)c1ccc(c(c1)F)Cl
Complexity:
160
Covalently-bondedUnitCount:
1
HeavyAtomCount:
11
HydrogenBondAcceptorCount:
2
RotatableBondCount:
1
Xlogp3:
2.3
CatalogNumber: AB44932
ChemicalName: 4-Chloro-3-fluorobenzonitrile
CasNumber: 110888-15-8
MolecularFormula: C7H3ClFN
MolecularWeight: 155.5568
MdlNumber: MFCD00143291
Smiles: N#Cc1ccc(c(c1)F)Cl
Complexity: 162
Covalently-bondedUnitCount: 1
HeavyAtomCount: 10
HydrogenBondAcceptorCount: 2
RotatableBondCount: __
Xlogp3: 2.4
CatalogNumber:
AB44932
ChemicalName:
4-Chloro-3-fluorobenzonitrile
CasNumber:
110888-15-8
MolecularFormula:
C7H3ClFN
MolecularWeight:
155.5568
MdlNumber:
MFCD00143291
Smiles:
N#Cc1ccc(c(c1)F)Cl
Complexity:
162
Covalently-bondedUnitCount:
1
HeavyAtomCount:
10
HydrogenBondAcceptorCount:
2
RotatableBondCount:
__
Xlogp3:
2.4
CatalogNumber: AB44933
ChemicalName: 4-Chloro-3-fluoropyridine
CasNumber: 2546-56-7
MolecularFormula: C5H3ClFN
MolecularWeight: 131.5354
MdlNumber: MFCD03453233
Smiles: Fc1cnccc1Cl
Complexity: 78.8
Covalently-bondedUnitCount: 1
HeavyAtomCount: 8
HydrogenBondAcceptorCount: 2
RotatableBondCount: __
Xlogp3: 1.6
CatalogNumber:
AB44933
ChemicalName:
4-Chloro-3-fluoropyridine
CasNumber:
2546-56-7
MolecularFormula:
C5H3ClFN
MolecularWeight:
131.5354
MdlNumber:
MFCD03453233
Smiles:
Fc1cnccc1Cl
Complexity:
78.8
Covalently-bondedUnitCount:
1
HeavyAtomCount:
8
HydrogenBondAcceptorCount:
2
RotatableBondCount:
__
Xlogp3:
1.6