AI50014
41016-29-9 | 3-Methyl-4-phenyl-2,5-furandione
Manufacturer: A2B Chem
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CatalogNumber
AI50014
ChemicalName
3-Methyl-4-phenyl-2,5-furandione
CasNumber
41016-29-9
MolecularFormula
C11H8O3
MolecularWeight
188.1794
MdlNumber
MFCD09867783
Smiles
O=C1OC(=O)C(=C1c1ccccc1)C
NscNumber
171189
Complexity
309
Covalently-bondedUnitCount
1
HeavyAtomCount
14
HydrogenBondAcceptorCount
3
RotatableBondCount
1
Xlogp3
1.9
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CatalogNumber: AI50014
ChemicalName: 3-Methyl-4-phenyl-2,5-furandione
CasNumber: 41016-29-9
MolecularFormula: C11H8O3
MolecularWeight: 188.1794
MdlNumber: MFCD09867783
Smiles: O=C1OC(=O)C(=C1c1ccccc1)C
NscNumber: 171189
Complexity: 309
Covalently-bondedUnitCount: 1
HeavyAtomCount: 14
HydrogenBondAcceptorCount: 3
RotatableBondCount: 1
Xlogp3: 1.9
CatalogNumber:
AI50014
ChemicalName:
3-Methyl-4-phenyl-2,5-furandione
CasNumber:
41016-29-9
MolecularFormula:
C11H8O3
MolecularWeight:
188.1794
MdlNumber:
MFCD09867783
Smiles:
O=C1OC(=O)C(=C1c1ccccc1)C
NscNumber:
171189
Complexity:
309
Covalently-bondedUnitCount:
1
HeavyAtomCount:
14
HydrogenBondAcceptorCount:
3
RotatableBondCount:
1
Xlogp3:
1.9
CatalogNumber: AI50015
ChemicalName: 2,3-Dimethyl-7-nitro-1h-indole
CasNumber: 41018-86-4
MolecularFormula: C10H10N2O2
MolecularWeight: 190.1986
MdlNumber: MFCD00022710
Smiles: Cc1c(C)[nH]c2c1cccc2[N+](=O)[O-]
NscNumber: 88618
Complexity: 239
Covalently-bondedUnitCount: 1
HeavyAtomCount: 14
HydrogenBondAcceptorCount: 2
RotatableBondCount: __
Xlogp3: 2.6
CatalogNumber:
AI50015
ChemicalName:
2,3-Dimethyl-7-nitro-1h-indole
CasNumber:
41018-86-4
MolecularFormula:
C10H10N2O2
MolecularWeight:
190.1986
MdlNumber:
MFCD00022710
Smiles:
Cc1c(C)[nH]c2c1cccc2[N+](=O)[O-]
NscNumber:
88618
Complexity:
239
Covalently-bondedUnitCount:
1
HeavyAtomCount:
14
HydrogenBondAcceptorCount:
2
RotatableBondCount:
__
Xlogp3:
2.6
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: Clc1ccc2c(c1)c(C)c([nH]2)c1ccccc1
NscNumber: __
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
Clc1ccc2c(c1)c(C)c([nH]2)c1ccccc1
NscNumber:
__
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: Ic1cc(I)c(cc1C)C
NscNumber: __
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
Ic1cc(I)c(cc1C)C
NscNumber:
__
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__