AB51732
38250-16-7 | Methyl 2-(4-hydroxyphenyl)-2-oxoacetate
Manufacturer: A2B Chem
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CatalogNumber
AB51732
ChemicalName
Methyl 2-(4-hydroxyphenyl)-2-oxoacetate
CasNumber
38250-16-7
MolecularFormula
C9H8O4
MolecularWeight
180.1574
MdlNumber
MFCD24713493
Smiles
COC(=O)C(=O)c1ccc(cc1)O
Complexity
204
Covalently-bondedUnitCount
1
HeavyAtomCount
13
HydrogenBondAcceptorCount
4
HydrogenBondDonorCount
1
RotatableBondCount
3
Xlogp3
1.3
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CatalogNumber: AB51732
ChemicalName: Methyl 2-(4-hydroxyphenyl)-2-oxoacetate
CasNumber: 38250-16-7
MolecularFormula: C9H8O4
MolecularWeight: 180.1574
MdlNumber: MFCD24713493
Smiles: COC(=O)C(=O)c1ccc(cc1)O
Complexity: 204
Covalently-bondedUnitCount: 1
HeavyAtomCount: 13
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: 1
RotatableBondCount: 3
Xlogp3: 1.3
CatalogNumber:
AB51732
ChemicalName:
Methyl 2-(4-hydroxyphenyl)-2-oxoacetate
CasNumber:
38250-16-7
MolecularFormula:
C9H8O4
MolecularWeight:
180.1574
MdlNumber:
MFCD24713493
Smiles:
COC(=O)C(=O)c1ccc(cc1)O
Complexity:
204
Covalently-bondedUnitCount:
1
HeavyAtomCount:
13
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
1
RotatableBondCount:
3
Xlogp3:
1.3
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: O[C@@H]1C[C@@H]2[C@@H]3[C@H]([C@H](C1)N2C)O3.Cl
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
O[C@@H]1C[C@@H]2[C@@H]3[C@H]([C@H](C1)N2C)O3.Cl
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: O=C(NC1CCN(CC1)Cc1ccccc1)COc1ccc(cc1)C(=O)c1ccccc1
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
O=C(NC1CCN(CC1)Cc1ccccc1)COc1ccc(cc1)C(=O)c1ccccc1
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: OC(=O)CCCC[C@@H]1SC[C@H]2[C@@H]1NC(=O)N2
Complexity: 298
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: 0.3
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
OC(=O)CCCC[C@@H]1SC[C@H]2[C@@H]1NC(=O)N2
Complexity:
298
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
0.3