AA69622
142166-00-5 | Methyl 3-oxo-2,4-dihydro-1,4-benzoxazine-7-carboxylate
Manufacturer: A2B Chem
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CatalogNumber
AA69622
ChemicalName
Methyl 3-oxo-2,4-dihydro-1,4-benzoxazine-7-carboxylate
CasNumber
142166-00-5
MolecularFormula
C10H9NO4
MolecularWeight
207.1828
MdlNumber
MFCD07774184
Smiles
COC(=O)c1ccc2c(c1)OCC(=O)N2
Complexity
279
Covalently-bondedUnitCount
1
HeavyAtomCount
15
HydrogenBondAcceptorCount
4
HydrogenBondDonorCount
1
RotatableBondCount
2
Xlogp3
0.7
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CatalogNumber: AA69622
ChemicalName: Methyl 3-oxo-2,4-dihydro-1,4-benzoxazine-7-carboxylate
CasNumber: 142166-00-5
MolecularFormula: C10H9NO4
MolecularWeight: 207.1828
MdlNumber: MFCD07774184
Smiles: COC(=O)c1ccc2c(c1)OCC(=O)N2
Complexity: 279
Covalently-bondedUnitCount: 1
HeavyAtomCount: 15
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: 1
RotatableBondCount: 2
Xlogp3: 0.7
CatalogNumber:
AA69622
ChemicalName:
Methyl 3-oxo-2,4-dihydro-1,4-benzoxazine-7-carboxylate
CasNumber:
142166-00-5
MolecularFormula:
C10H9NO4
MolecularWeight:
207.1828
MdlNumber:
MFCD07774184
Smiles:
COC(=O)c1ccc2c(c1)OCC(=O)N2
Complexity:
279
Covalently-bondedUnitCount:
1
HeavyAtomCount:
15
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
1
RotatableBondCount:
2
Xlogp3:
0.7
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Smiles: Cc1ncn(c1)c1ccc(cc1)C(=O)C
Complexity: __
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HydrogenBondAcceptorCount: __
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Smiles:
Cc1ncn(c1)c1ccc(cc1)C(=O)C
Complexity:
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__
HydrogenBondAcceptorCount:
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RotatableBondCount:
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Smiles: [O-]C(=O)c1ccc(c(c1)Cl)F.[Na+]
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
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__
ChemicalName:
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CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
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Smiles:
[O-]C(=O)c1ccc(c(c1)Cl)F.[Na+]
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
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ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: [O-]C(=O)c1cc(F)c(cc1Cl)F.[Na+]
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
[O-]C(=O)c1cc(F)c(cc1Cl)F.[Na+]
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__