AA61892
140-26-1 | Phenylethyl isovalerate
Manufacturer: A2B Chem
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CatalogNumber
AA61892
ChemicalName
Phenylethyl isovalerate
CasNumber
140-26-1
MolecularFormula
C13H18O2
MolecularWeight
206.2808
MdlNumber
MFCD00044322
Smiles
CC(CC(=O)OCCc1ccccc1)C
NscNumber
21899
Complexity
181
Covalently-bondedUnitCount
1
HeavyAtomCount
15
HydrogenBondAcceptorCount
2
RotatableBondCount
6
Xlogp3
3.6
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CatalogNumber: AA61892
ChemicalName: Phenylethyl isovalerate
CasNumber: 140-26-1
MolecularFormula: C13H18O2
MolecularWeight: 206.2808
MdlNumber: MFCD00044322
Smiles: CC(CC(=O)OCCc1ccccc1)C
NscNumber: 21899
Complexity: 181
Covalently-bondedUnitCount: 1
HeavyAtomCount: 15
HydrogenBondAcceptorCount: 2
RotatableBondCount: 6
Xlogp3: 3.6
CatalogNumber:
AA61892
ChemicalName:
Phenylethyl isovalerate
CasNumber:
140-26-1
MolecularFormula:
C13H18O2
MolecularWeight:
206.2808
MdlNumber:
MFCD00044322
Smiles:
CC(CC(=O)OCCc1ccccc1)C
NscNumber:
21899
Complexity:
181
Covalently-bondedUnitCount:
1
HeavyAtomCount:
15
HydrogenBondAcceptorCount:
2
RotatableBondCount:
6
Xlogp3:
3.6
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: CCCCCCCCCCCC(=O)OCc1ccccc1
NscNumber: __
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
CCCCCCCCCCCC(=O)OCc1ccccc1
NscNumber:
__
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: O=C(OCc1ccccc1)CCCCCCCCC(=O)OCc1ccccc1
NscNumber: __
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
O=C(OCc1ccccc1)CCCCCCCCC(=O)OCc1ccccc1
NscNumber:
__
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: AA61895
ChemicalName: 1,5-Diphenylcarbazide
CasNumber: 140-22-7
MolecularFormula: C13H14N4O
MolecularWeight: 242.2765
MdlNumber: MFCD00003013
Smiles: O=C(NNc1ccccc1)NNc1ccccc1
NscNumber: 5058
Complexity: 223
Covalently-bondedUnitCount: 1
HeavyAtomCount: 18
HydrogenBondAcceptorCount: 3
RotatableBondCount: 4
Xlogp3: 3.1
CatalogNumber:
AA61895
ChemicalName:
1,5-Diphenylcarbazide
CasNumber:
140-22-7
MolecularFormula:
C13H14N4O
MolecularWeight:
242.2765
MdlNumber:
MFCD00003013
Smiles:
O=C(NNc1ccccc1)NNc1ccccc1
NscNumber:
5058
Complexity:
223
Covalently-bondedUnitCount:
1
HeavyAtomCount:
18
HydrogenBondAcceptorCount:
3
RotatableBondCount:
4
Xlogp3:
3.1