AC57697
81721-86-0 | 7-Nitro-2H-1,4-benzoxazin-3(4H)-one
Manufacturer: A2B Chem
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CatalogNumber
AC57697
ChemicalName
7-Nitro-2H-1,4-benzoxazin-3(4H)-one
CasNumber
81721-86-0
MolecularFormula
C8H6N2O4
MolecularWeight
194.14424
MdlNumber
MFCD00090355
Smiles
O=C1COc2c(N1)ccc(c2)[N+](=O)[O-]
Complexity
263
Covalently-bondedUnitCount
1
HeavyAtomCount
14
HydrogenBondAcceptorCount
4
HydrogenBondDonorCount
1
Xlogp3
0.7
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CatalogNumber: AC57697
ChemicalName: 7-Nitro-2H-1,4-benzoxazin-3(4H)-one
CasNumber: 81721-86-0
MolecularFormula: C8H6N2O4
MolecularWeight: 194.14424
MdlNumber: MFCD00090355
Smiles: O=C1COc2c(N1)ccc(c2)[N+](=O)[O-]
Complexity: 263
Covalently-bondedUnitCount: 1
HeavyAtomCount: 14
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: 1
Xlogp3: 0.7
CatalogNumber:
AC57697
ChemicalName:
7-Nitro-2H-1,4-benzoxazin-3(4H)-one
CasNumber:
81721-86-0
MolecularFormula:
C8H6N2O4
MolecularWeight:
194.14424
MdlNumber:
MFCD00090355
Smiles:
O=C1COc2c(N1)ccc(c2)[N+](=O)[O-]
Complexity:
263
Covalently-bondedUnitCount:
1
HeavyAtomCount:
14
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
1
Xlogp3:
0.7
CatalogNumber: __
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CasNumber: __
MolecularFormula: __
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Smiles: O=C1c2ccccc2-c2c1c1ccccc1c(=O)n2c1ccccc1
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
Xlogp3: __
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MolecularFormula:
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Smiles:
O=C1c2ccccc2-c2c1c1ccccc1c(=O)n2c1ccccc1
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
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HydrogenBondDonorCount:
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Xlogp3:
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MolecularFormula: __
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Smiles: O=C1c2c3ccccc3c(=O)n(c2-c2c1cccc2)Cc1ccco1
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
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CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
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Smiles:
O=C1c2c3ccccc3c(=O)n(c2-c2c1cccc2)Cc1ccco1
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
Xlogp3:
__
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ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: CCCn1c2-c3ccccc3C(=O)c2c2c(c1=O)cccc2
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
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CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
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Smiles:
CCCn1c2-c3ccccc3C(=O)c2c2c(c1=O)cccc2
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
Xlogp3:
__