AC65772
6786-30-7 | 3,4-Dihydro-2h-benzo[b]oxepin-5-one
Manufacturer: A2B Chem
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CatalogNumber
AC65772
ChemicalName
3,4-Dihydro-2h-benzo[b]oxepin-5-one
CasNumber
6786-30-7
MolecularFormula
C10H10O2
MolecularWeight
162.1852
MdlNumber
MFCD01648756
Smiles
O=C1CCCOc2c1cccc2
NscNumber
241045
Complexity
177
Covalently-bondedUnitCount
1
HeavyAtomCount
12
HydrogenBondAcceptorCount
2
Xlogp3
1.7
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CatalogNumber: AC65772
ChemicalName: 3,4-Dihydro-2h-benzo[b]oxepin-5-one
CasNumber: 6786-30-7
MolecularFormula: C10H10O2
MolecularWeight: 162.1852
MdlNumber: MFCD01648756
Smiles: O=C1CCCOc2c1cccc2
NscNumber: 241045
Complexity: 177
Covalently-bondedUnitCount: 1
HeavyAtomCount: 12
HydrogenBondAcceptorCount: 2
Xlogp3: 1.7
CatalogNumber:
AC65772
ChemicalName:
3,4-Dihydro-2h-benzo[b]oxepin-5-one
CasNumber:
6786-30-7
MolecularFormula:
C10H10O2
MolecularWeight:
162.1852
MdlNumber:
MFCD01648756
Smiles:
O=C1CCCOc2c1cccc2
NscNumber:
241045
Complexity:
177
Covalently-bondedUnitCount:
1
HeavyAtomCount:
12
HydrogenBondAcceptorCount:
2
Xlogp3:
1.7
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: CCCCCCCC[C@@H](C(=O)O)NC(=O)OC(C)(C)C
NscNumber: __
Complexity: 297
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
Xlogp3: 4.5
CatalogNumber:
__
ChemicalName:
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CasNumber:
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MolecularFormula:
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MolecularWeight:
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MdlNumber:
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Smiles:
CCCCCCCC[C@@H](C(=O)O)NC(=O)OC(C)(C)C
NscNumber:
__
Complexity:
297
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
Xlogp3:
4.5
CatalogNumber: __
ChemicalName: __
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MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: CCC(=O)OC(CCC=C(C)C)(C#C)C
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Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
Xlogp3: __
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CasNumber:
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MolecularFormula:
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MolecularWeight:
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MdlNumber:
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Smiles:
CCC(=O)OC(CCC=C(C)C)(C#C)C
NscNumber:
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Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
Xlogp3:
__
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CasNumber: __
MolecularFormula: __
MolecularWeight: __
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Smiles: Oc1ccc2c(c1)oc(cc2=O)c1cc(O)c(c(c1)O)O
NscNumber: __
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
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CasNumber:
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MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
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Smiles:
Oc1ccc2c(c1)oc(cc2=O)c1cc(O)c(c(c1)O)O
NscNumber:
__
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
Xlogp3:
__