AB46888
4421-09-4 | Piperonylonitrile
Manufacturer: A2B Chem
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CatalogNumber
AB46888
ChemicalName
Piperonylonitrile
CasNumber
4421-09-4
MolecularFormula
C8H5NO2
MolecularWeight
147.13080000000002
MdlNumber
MFCD00005820
Smiles
N#Cc1ccc2c(c1)OCO2
NscNumber
27009
Complexity
196
Covalently-bondedUnitCount
1
HeavyAtomCount
11
HydrogenBondAcceptorCount
3
Xlogp3
1.3
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CatalogNumber: AB46888
ChemicalName: Piperonylonitrile
CasNumber: 4421-09-4
MolecularFormula: C8H5NO2
MolecularWeight: 147.13080000000002
MdlNumber: MFCD00005820
Smiles: N#Cc1ccc2c(c1)OCO2
NscNumber: 27009
Complexity: 196
Covalently-bondedUnitCount: 1
HeavyAtomCount: 11
HydrogenBondAcceptorCount: 3
Xlogp3: 1.3
CatalogNumber:
AB46888
ChemicalName:
Piperonylonitrile
CasNumber:
4421-09-4
MolecularFormula:
C8H5NO2
MolecularWeight:
147.13080000000002
MdlNumber:
MFCD00005820
Smiles:
N#Cc1ccc2c(c1)OCO2
NscNumber:
27009
Complexity:
196
Covalently-bondedUnitCount:
1
HeavyAtomCount:
11
HydrogenBondAcceptorCount:
3
Xlogp3:
1.3
CatalogNumber: AB46889
ChemicalName: Pirfenidone
CasNumber: 53179-13-8
MolecularFormula: C12H11NO
MolecularWeight: 185.2218
MdlNumber: MFCD00866047
Smiles: Cc1ccc(=O)n(c1)c1ccccc1
NscNumber: 748456
Complexity: 285
Covalently-bondedUnitCount: 1
HeavyAtomCount: 14
HydrogenBondAcceptorCount: 1
Xlogp3: 1.9
CatalogNumber:
AB46889
ChemicalName:
Pirfenidone
CasNumber:
53179-13-8
MolecularFormula:
C12H11NO
MolecularWeight:
185.2218
MdlNumber:
MFCD00866047
Smiles:
Cc1ccc(=O)n(c1)c1ccccc1
NscNumber:
748456
Complexity:
285
Covalently-bondedUnitCount:
1
HeavyAtomCount:
14
HydrogenBondAcceptorCount:
1
Xlogp3:
1.9
CatalogNumber: AB46890
ChemicalName: Pivalamide
CasNumber: 754-10-9
MolecularFormula: C5H11NO
MolecularWeight: 101.1469
MdlNumber: MFCD00008011
Smiles: NC(=O)C(C)(C)C
NscNumber: 17584
Complexity: 80.6
Covalently-bondedUnitCount: 1
HeavyAtomCount: 7
HydrogenBondAcceptorCount: 1
Xlogp3: 0.5
CatalogNumber:
AB46890
ChemicalName:
Pivalamide
CasNumber:
754-10-9
MolecularFormula:
C5H11NO
MolecularWeight:
101.1469
MdlNumber:
MFCD00008011
Smiles:
NC(=O)C(C)(C)C
NscNumber:
17584
Complexity:
80.6
Covalently-bondedUnitCount:
1
HeavyAtomCount:
7
HydrogenBondAcceptorCount:
1
Xlogp3:
0.5
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: OC(=O)C(C)(C)C
NscNumber: __
Complexity: 78.6
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
Xlogp3: 1.5
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
OC(=O)C(C)(C)C
NscNumber:
__
Complexity:
78.6
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
Xlogp3:
1.5