AA36167
1261869-76-4 | 1-Oxoisoindoline-5-carbonitrile
Manufacturer: A2B Chem
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CatalogNumber
AA36167
ChemicalName
1-Oxoisoindoline-5-carbonitrile
CasNumber
1261869-76-4
MolecularFormula
C9H6N2O
MolecularWeight
158.1567
MdlNumber
MFCD12924852
Smiles
N#Cc1ccc2c(c1)CNC2=O
Complexity
253
Covalently-bondedUnitCount
1
HeavyAtomCount
12
HydrogenBondAcceptorCount
2
HydrogenBondDonorCount
1
Xlogp3
0.5
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CatalogNumber: AA36167
ChemicalName: 1-Oxoisoindoline-5-carbonitrile
CasNumber: 1261869-76-4
MolecularFormula: C9H6N2O
MolecularWeight: 158.1567
MdlNumber: MFCD12924852
Smiles: N#Cc1ccc2c(c1)CNC2=O
Complexity: 253
Covalently-bondedUnitCount: 1
HeavyAtomCount: 12
HydrogenBondAcceptorCount: 2
HydrogenBondDonorCount: 1
Xlogp3: 0.5
CatalogNumber:
AA36167
ChemicalName:
1-Oxoisoindoline-5-carbonitrile
CasNumber:
1261869-76-4
MolecularFormula:
C9H6N2O
MolecularWeight:
158.1567
MdlNumber:
MFCD12924852
Smiles:
N#Cc1ccc2c(c1)CNC2=O
Complexity:
253
Covalently-bondedUnitCount:
1
HeavyAtomCount:
12
HydrogenBondAcceptorCount:
2
HydrogenBondDonorCount:
1
Xlogp3:
0.5
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: COC(=O)c1c(F)cc(cc1Cl)F
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
COC(=O)c1c(F)cc(cc1Cl)F
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: O=Cc1ccc(c(c1Cl)F)F
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
O=Cc1ccc(c(c1Cl)F)F
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: OC(=O)c1cc(ccc1F)c1cccc(c1)OC(F)(F)F
Complexity: 372
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
Xlogp3: 4.4
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
OC(=O)c1cc(ccc1F)c1cccc(c1)OC(F)(F)F
Complexity:
372
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
Xlogp3:
4.4