AH13739
6729-50-6 | 2,3,4,5-Tetrahydro-benzo[c]azepin-1-one
Manufacturer: A2B Chem
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CatalogNumber
AH13739
ChemicalName
2,3,4,5-Tetrahydro-benzo[c]azepin-1-one
CasNumber
6729-50-6
MolecularFormula
C10H11NO
MolecularWeight
161.2004
MdlNumber
MFCD04114867
Smiles
O=C1NCCCc2c1cccc2
Complexity
179
Covalently-bondedUnitCount
1
HeavyAtomCount
12
HydrogenBondAcceptorCount
1
HydrogenBondDonorCount
1
Xlogp3
1.6
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CatalogNumber: AH13739
ChemicalName: 2,3,4,5-Tetrahydro-benzo[c]azepin-1-one
CasNumber: 6729-50-6
MolecularFormula: C10H11NO
MolecularWeight: 161.2004
MdlNumber: MFCD04114867
Smiles: O=C1NCCCc2c1cccc2
Complexity: 179
Covalently-bondedUnitCount: 1
HeavyAtomCount: 12
HydrogenBondAcceptorCount: 1
HydrogenBondDonorCount: 1
Xlogp3: 1.6
CatalogNumber:
AH13739
ChemicalName:
2,3,4,5-Tetrahydro-benzo[c]azepin-1-one
CasNumber:
6729-50-6
MolecularFormula:
C10H11NO
MolecularWeight:
161.2004
MdlNumber:
MFCD04114867
Smiles:
O=C1NCCCc2c1cccc2
Complexity:
179
Covalently-bondedUnitCount:
1
HeavyAtomCount:
12
HydrogenBondAcceptorCount:
1
HydrogenBondDonorCount:
1
Xlogp3:
1.6
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Smiles: OC(=O)[C@H]1COCC1
Complexity: __
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HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
Xlogp3: __
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__
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MolecularFormula:
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MolecularWeight:
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Smiles:
OC(=O)[C@H]1COCC1
Complexity:
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Covalently-bondedUnitCount:
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HeavyAtomCount:
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HydrogenBondAcceptorCount:
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HydrogenBondDonorCount:
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Xlogp3:
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Smiles: Clc1ccc(cc1)C(N(C(=O)OCc1ccccc1)C)CN1CCCC1
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Smiles:
Clc1ccc(cc1)C(N(C(=O)OCc1ccccc1)C)CN1CCCC1
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HeavyAtomCount:
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Smiles: OC[C@@H](N(C(=O)OCc1ccccc1)C)CN1CCCC1
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
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CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
OC[C@@H](N(C(=O)OCc1ccccc1)C)CN1CCCC1
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
Xlogp3:
__