AB81397
99822-50-1 | 1,4-Diazepan-2-one
Manufacturer: A2B Chem
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CatalogNumber
AB81397
ChemicalName
1,4-Diazepan-2-one
CasNumber
99822-50-1
MolecularFormula
C5H10N2O
MolecularWeight
114.1457
MdlNumber
MFCD06804501
Smiles
O=C1CNCCCN1
Complexity
92.4
Covalently-bondedUnitCount
1
HeavyAtomCount
8
HydrogenBondAcceptorCount
2
HydrogenBondDonorCount
2
Xlogp3
-0.7
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CatalogNumber: AB81397
ChemicalName: 1,4-Diazepan-2-one
CasNumber: 99822-50-1
MolecularFormula: C5H10N2O
MolecularWeight: 114.1457
MdlNumber: MFCD06804501
Smiles: O=C1CNCCCN1
Complexity: 92.4
Covalently-bondedUnitCount: 1
HeavyAtomCount: 8
HydrogenBondAcceptorCount: 2
HydrogenBondDonorCount: 2
Xlogp3: -0.7
CatalogNumber:
AB81397
ChemicalName:
1,4-Diazepan-2-one
CasNumber:
99822-50-1
MolecularFormula:
C5H10N2O
MolecularWeight:
114.1457
MdlNumber:
MFCD06804501
Smiles:
O=C1CNCCCN1
Complexity:
92.4
Covalently-bondedUnitCount:
1
HeavyAtomCount:
8
HydrogenBondAcceptorCount:
2
HydrogenBondDonorCount:
2
Xlogp3:
-0.7
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: BrCc1ccc(c(c1)C(=O)C)[N+](=O)[O-]
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
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Smiles:
BrCc1ccc(c(c1)C(=O)C)[N+](=O)[O-]
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: OCCC(CCO)CO
Complexity: __
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HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
Xlogp3: __
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:
OCCC(CCO)CO
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: Clc1cc2[nH]nnc2cc1F
Complexity: __
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HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
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CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
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Smiles:
Clc1cc2[nH]nnc2cc1F
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
Xlogp3:
__