AE51035
1125-85-5 | 3,4-Dihydro-1,3-benzoxazin-2-one
Manufacturer: A2B Chem
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CatalogNumber
AE51035
ChemicalName
3,4-Dihydro-1,3-benzoxazin-2-one
CasNumber
1125-85-5
MolecularFormula
C8H7NO2
MolecularWeight
149.1467
MdlNumber
MFCD02313739
Smiles
O=C1NCc2c(O1)cccc2
Complexity
170
Covalently-bondedUnitCount
1
HeavyAtomCount
11
HydrogenBondAcceptorCount
2
HydrogenBondDonorCount
1
Xlogp3
1.1
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CatalogNumber: AE51035
ChemicalName: 3,4-Dihydro-1,3-benzoxazin-2-one
CasNumber: 1125-85-5
MolecularFormula: C8H7NO2
MolecularWeight: 149.1467
MdlNumber: MFCD02313739
Smiles: O=C1NCc2c(O1)cccc2
Complexity: 170
Covalently-bondedUnitCount: 1
HeavyAtomCount: 11
HydrogenBondAcceptorCount: 2
HydrogenBondDonorCount: 1
Xlogp3: 1.1
CatalogNumber:
AE51035
ChemicalName:
3,4-Dihydro-1,3-benzoxazin-2-one
CasNumber:
1125-85-5
MolecularFormula:
C8H7NO2
MolecularWeight:
149.1467
MdlNumber:
MFCD02313739
Smiles:
O=C1NCc2c(O1)cccc2
Complexity:
170
Covalently-bondedUnitCount:
1
HeavyAtomCount:
11
HydrogenBondAcceptorCount:
2
HydrogenBondDonorCount:
1
Xlogp3:
1.1
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Smiles: CCCn1c(=O)n(C)c(=O)c2c1nc[nH]2
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
Xlogp3: __
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Smiles:
CCCn1c(=O)n(C)c(=O)c2c1nc[nH]2
Complexity:
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HeavyAtomCount:
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Smiles: Cn1cnc2c(c1=S)[nH]cn2
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CasNumber:
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MolecularFormula:
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Smiles:
Cn1cnc2c(c1=S)[nH]cn2
Complexity:
__
Covalently-bondedUnitCount:
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HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
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Xlogp3:
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Smiles: C=Cn1cc(c2c1cccc2)C[C@]([C@@]1(O)OC[C@@H](C1)O)(C(=O)O)O
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
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CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
C=Cn1cc(c2c1cccc2)C[C@]([C@@]1(O)OC[C@@H](C1)O)(C(=O)O)O
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
Xlogp3:
__