AB15059
1885-35-4 | 3,4,5-Trimethoxybenzonitrile
Manufacturer: A2B Chem
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CatalogNumber
AB15059
ChemicalName
3,4,5-Trimethoxybenzonitrile
CasNumber
1885-35-4
MolecularFormula
C10H11NO3
MolecularWeight
193.1992
MdlNumber
MFCD00001803
Smiles
COc1cc(C#N)cc(c1OC)OC
NscNumber
408924
Complexity
209
Covalently-bondedUnitCount
1
HeavyAtomCount
14
HydrogenBondAcceptorCount
4
RotatableBondCount
3
Xlogp3
1.2
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CatalogNumber: AB15059
ChemicalName: 3,4,5-Trimethoxybenzonitrile
CasNumber: 1885-35-4
MolecularFormula: C10H11NO3
MolecularWeight: 193.1992
MdlNumber: MFCD00001803
Smiles: COc1cc(C#N)cc(c1OC)OC
NscNumber: 408924
Complexity: 209
Covalently-bondedUnitCount: 1
HeavyAtomCount: 14
HydrogenBondAcceptorCount: 4
RotatableBondCount: 3
Xlogp3: 1.2
CatalogNumber:
AB15059
ChemicalName:
3,4,5-Trimethoxybenzonitrile
CasNumber:
1885-35-4
MolecularFormula:
C10H11NO3
MolecularWeight:
193.1992
MdlNumber:
MFCD00001803
Smiles:
COc1cc(C#N)cc(c1OC)OC
NscNumber:
408924
Complexity:
209
Covalently-bondedUnitCount:
1
HeavyAtomCount:
14
HydrogenBondAcceptorCount:
4
RotatableBondCount:
3
Xlogp3:
1.2
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: NC(=O)c1cccc(c1N)C
NscNumber: __
Complexity: 158
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: 1
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
NC(=O)c1cccc(c1N)C
NscNumber:
__
Complexity:
158
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
1
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: NC(=O)c1c(C)cccc1N
NscNumber: __
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
NC(=O)c1c(C)cccc1N
NscNumber:
__
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: AB15063
ChemicalName: 2-Aminobenzonitrile
CasNumber: 1885-29-6
MolecularFormula: C7H6N2
MolecularWeight: 118.1359
MdlNumber: MFCD00007631
Smiles: N#Cc1ccccc1N
NscNumber: __
Complexity: 133
Covalently-bondedUnitCount: 1
HeavyAtomCount: 9
HydrogenBondAcceptorCount: 2
RotatableBondCount: __
Xlogp3: 1.4
CatalogNumber:
AB15063
ChemicalName:
2-Aminobenzonitrile
CasNumber:
1885-29-6
MolecularFormula:
C7H6N2
MolecularWeight:
118.1359
MdlNumber:
MFCD00007631
Smiles:
N#Cc1ccccc1N
NscNumber:
__
Complexity:
133
Covalently-bondedUnitCount:
1
HeavyAtomCount:
9
HydrogenBondAcceptorCount:
2
RotatableBondCount:
__
Xlogp3:
1.4