AA61959
14003-96-4 | 7-Hydroxy-4-methyl-2-oxo-2H-chromene-8-carbaldehyde
Manufacturer: A2B Chem
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CatalogNumber
AA61959
ChemicalName
7-Hydroxy-4-methyl-2-oxo-2H-chromene-8-carbaldehyde
CasNumber
14003-96-4
MolecularFormula
C11H8O4
MolecularWeight
204.1788
MdlNumber
MFCD12027255
Smiles
O=Cc1c(O)ccc2c1oc(=O)cc2C
Complexity
321
Covalently-bondedUnitCount
1
HeavyAtomCount
15
HydrogenBondAcceptorCount
4
HydrogenBondDonorCount
1
RotatableBondCount
1
Xlogp3
1.5
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CatalogNumber: AA61959
ChemicalName: 7-Hydroxy-4-methyl-2-oxo-2H-chromene-8-carbaldehyde
CasNumber: 14003-96-4
MolecularFormula: C11H8O4
MolecularWeight: 204.1788
MdlNumber: MFCD12027255
Smiles: O=Cc1c(O)ccc2c1oc(=O)cc2C
Complexity: 321
Covalently-bondedUnitCount: 1
HeavyAtomCount: 15
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: 1
RotatableBondCount: 1
Xlogp3: 1.5
CatalogNumber:
AA61959
ChemicalName:
7-Hydroxy-4-methyl-2-oxo-2H-chromene-8-carbaldehyde
CasNumber:
14003-96-4
MolecularFormula:
C11H8O4
MolecularWeight:
204.1788
MdlNumber:
MFCD12027255
Smiles:
O=Cc1c(O)ccc2c1oc(=O)cc2C
Complexity:
321
Covalently-bondedUnitCount:
1
HeavyAtomCount:
15
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
1
RotatableBondCount:
1
Xlogp3:
1.5
CatalogNumber: AA61960
ChemicalName: 4-Methyl-5-nitroimidazole
CasNumber: 14003-66-8
MolecularFormula: C4H5N3O2
MolecularWeight: 127.1014
MdlNumber: MFCD01721395
Smiles: [O-][N+](=O)c1c(C)nc[nH]1
Complexity: 122
Covalently-bondedUnitCount: 1
HeavyAtomCount: 9
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: 1
RotatableBondCount: __
Xlogp3: 0.2
CatalogNumber:
AA61960
ChemicalName:
4-Methyl-5-nitroimidazole
CasNumber:
14003-66-8
MolecularFormula:
C4H5N3O2
MolecularWeight:
127.1014
MdlNumber:
MFCD01721395
Smiles:
[O-][N+](=O)c1c(C)nc[nH]1
Complexity:
122
Covalently-bondedUnitCount:
1
HeavyAtomCount:
9
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
1
RotatableBondCount:
__
Xlogp3:
0.2
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: N#CCc1ccnc2c1cccc2
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
N#CCc1ccnc2c1cccc2
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: CCOC(=O)C(=O)Cc1nc2ccccc2n(c1=O)C
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
CCOC(=O)C(=O)Cc1nc2ccccc2n(c1=O)C
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__