AB67741
40150-98-9 | 4-Isobutylbenzaldehyde
Manufacturer: A2B Chem
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CatalogNumber
AB67741
ChemicalName
4-Isobutylbenzaldehyde
CasNumber
40150-98-9
MolecularFormula
C11H14O
MolecularWeight
162.22826
MdlNumber
MFCD00075760
Smiles
O=Cc1ccc(cc1)CC(C)C
Complexity
132
Covalently-bondedUnitCount
1
HeavyAtomCount
12
HydrogenBondAcceptorCount
1
RotatableBondCount
3
Xlogp3
3
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CatalogNumber: AB67741
ChemicalName: 4-Isobutylbenzaldehyde
CasNumber: 40150-98-9
MolecularFormula: C11H14O
MolecularWeight: 162.22826
MdlNumber: MFCD00075760
Smiles: O=Cc1ccc(cc1)CC(C)C
Complexity: 132
Covalently-bondedUnitCount: 1
HeavyAtomCount: 12
HydrogenBondAcceptorCount: 1
RotatableBondCount: 3
Xlogp3: 3
CatalogNumber:
AB67741
ChemicalName:
4-Isobutylbenzaldehyde
CasNumber:
40150-98-9
MolecularFormula:
C11H14O
MolecularWeight:
162.22826
MdlNumber:
MFCD00075760
Smiles:
O=Cc1ccc(cc1)CC(C)C
Complexity:
132
Covalently-bondedUnitCount:
1
HeavyAtomCount:
12
HydrogenBondAcceptorCount:
1
RotatableBondCount:
3
Xlogp3:
3
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: CC(Cc1ccc(cc1)C(=O)O)C
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
CC(Cc1ccc(cc1)C(=O)O)C
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: AB67743
ChemicalName: 4-Isocyanato-1,2-dimethoxybenzene
CasNumber: 37527-66-5
MolecularFormula: C9H9NO3
MolecularWeight: 179.1727
MdlNumber: MFCD01863688
Smiles: O=C=Nc1ccc(c(c1)OC)OC
Complexity: 201
Covalently-bondedUnitCount: 1
HeavyAtomCount: 13
HydrogenBondAcceptorCount: 4
RotatableBondCount: 3
Xlogp3: 2.9
CatalogNumber:
AB67743
ChemicalName:
4-Isocyanato-1,2-dimethoxybenzene
CasNumber:
37527-66-5
MolecularFormula:
C9H9NO3
MolecularWeight:
179.1727
MdlNumber:
MFCD01863688
Smiles:
O=C=Nc1ccc(c(c1)OC)OC
Complexity:
201
Covalently-bondedUnitCount:
1
HeavyAtomCount:
13
HydrogenBondAcceptorCount:
4
RotatableBondCount:
3
Xlogp3:
2.9
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: O=C=Nc1ccc(cc1)C(=O)c1ccccc1
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
O=C=Nc1ccc(cc1)C(=O)c1ccccc1
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__