AB67315
6068-72-0 | 4-Cyanobenzoyl chloride
Manufacturer: A2B Chem
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CatalogNumber
AB67315
ChemicalName
4-Cyanobenzoyl chloride
CasNumber
6068-72-0
MolecularFormula
C8H4ClNO
MolecularWeight
165.5765
MdlNumber
MFCD00001822
Smiles
N#Cc1ccc(cc1)C(=O)Cl
Complexity
197
Covalently-bondedUnitCount
1
HeavyAtomCount
11
HydrogenBondAcceptorCount
2
RotatableBondCount
1
Xlogp3
2.5
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CatalogNumber: AB67315
ChemicalName: 4-Cyanobenzoyl chloride
CasNumber: 6068-72-0
MolecularFormula: C8H4ClNO
MolecularWeight: 165.5765
MdlNumber: MFCD00001822
Smiles: N#Cc1ccc(cc1)C(=O)Cl
Complexity: 197
Covalently-bondedUnitCount: 1
HeavyAtomCount: 11
HydrogenBondAcceptorCount: 2
RotatableBondCount: 1
Xlogp3: 2.5
CatalogNumber:
AB67315
ChemicalName:
4-Cyanobenzoyl chloride
CasNumber:
6068-72-0
MolecularFormula:
C8H4ClNO
MolecularWeight:
165.5765
MdlNumber:
MFCD00001822
Smiles:
N#Cc1ccc(cc1)C(=O)Cl
Complexity:
197
Covalently-bondedUnitCount:
1
HeavyAtomCount:
11
HydrogenBondAcceptorCount:
2
RotatableBondCount:
1
Xlogp3:
2.5
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: CCOc1ccc(cc1)/N=C/c1ccc(cc1)C#N
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
CCOc1ccc(cc1)/N=C/c1ccc(cc1)C#N
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: CCCCOc1ccc(cc1)/N=C/c1ccc(cc1)C#N
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
CCCCOc1ccc(cc1)/N=C/c1ccc(cc1)C#N
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: AB67318
ChemicalName: 1,4-Dioxaspiro[4.5]decane-8-carbonitrile
CasNumber: 69947-09-7
MolecularFormula: C9H13NO2
MolecularWeight: 167.20502000000002
MdlNumber: MFCD09037879
Smiles: N#CC1CCC2(CC1)OCCO2
Complexity: 202
Covalently-bondedUnitCount: 1
HeavyAtomCount: 12
HydrogenBondAcceptorCount: 3
RotatableBondCount: __
Xlogp3: 0.6
CatalogNumber:
AB67318
ChemicalName:
1,4-Dioxaspiro[4.5]decane-8-carbonitrile
CasNumber:
69947-09-7
MolecularFormula:
C9H13NO2
MolecularWeight:
167.20502000000002
MdlNumber:
MFCD09037879
Smiles:
N#CC1CCC2(CC1)OCCO2
Complexity:
202
Covalently-bondedUnitCount:
1
HeavyAtomCount:
12
HydrogenBondAcceptorCount:
3
RotatableBondCount:
__
Xlogp3:
0.6