AD92816
867006-20-0 | 3,9-Diazaspiro[5.5]undecan-2-one
Manufacturer: A2B Chem
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CatalogNumber
AD92816
ChemicalName
3,9-Diazaspiro[5.5]undecan-2-one
CasNumber
867006-20-0
MolecularFormula
C9H16N2O
MolecularWeight
168.23614
MdlNumber
MFCD13179151
Smiles
O=C1NCCC2(C1)CCNCC2
Complexity
185
Covalently-bondedUnitCount
1
HeavyAtomCount
12
HydrogenBondAcceptorCount
2
HydrogenBondDonorCount
2
Xlogp3
-0.2
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CatalogNumber: AD92816
ChemicalName: 3,9-Diazaspiro[5.5]undecan-2-one
CasNumber: 867006-20-0
MolecularFormula: C9H16N2O
MolecularWeight: 168.23614
MdlNumber: MFCD13179151
Smiles: O=C1NCCC2(C1)CCNCC2
Complexity: 185
Covalently-bondedUnitCount: 1
HeavyAtomCount: 12
HydrogenBondAcceptorCount: 2
HydrogenBondDonorCount: 2
Xlogp3: -0.2
CatalogNumber:
AD92816
ChemicalName:
3,9-Diazaspiro[5.5]undecan-2-one
CasNumber:
867006-20-0
MolecularFormula:
C9H16N2O
MolecularWeight:
168.23614
MdlNumber:
MFCD13179151
Smiles:
O=C1NCCC2(C1)CCNCC2
Complexity:
185
Covalently-bondedUnitCount:
1
HeavyAtomCount:
12
HydrogenBondAcceptorCount:
2
HydrogenBondDonorCount:
2
Xlogp3:
-0.2
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: Brc1ccc(cc1)C(c1ccc(o1)C)c1ccc(o1)C
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
Brc1ccc(cc1)C(c1ccc(o1)C)c1ccc(o1)C
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: O=C1NCCNC1c1cccs1
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
O=C1NCCNC1c1cccs1
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
Xlogp3:
__
CatalogNumber: AD92819
ChemicalName: 6-(4-Methoxyphenyl)picolinic acid
CasNumber: 86696-70-0
MolecularFormula: C13H11NO3
MolecularWeight: 229.2313
MdlNumber: MFCD06410068
Smiles: COc1ccc(cc1)c1cccc(n1)C(=O)O
Complexity: 261
Covalently-bondedUnitCount: 1
HeavyAtomCount: 17
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: 1
Xlogp3: 2.3
CatalogNumber:
AD92819
ChemicalName:
6-(4-Methoxyphenyl)picolinic acid
CasNumber:
86696-70-0
MolecularFormula:
C13H11NO3
MolecularWeight:
229.2313
MdlNumber:
MFCD06410068
Smiles:
COc1ccc(cc1)c1cccc(n1)C(=O)O
Complexity:
261
Covalently-bondedUnitCount:
1
HeavyAtomCount:
17
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
1
Xlogp3:
2.3