AE09411
1073-79-6 | 2,6-Dimethyltetrahydro-4h-pyran-4-one
Manufacturer: A2B Chem
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CatalogNumber
AE09411
ChemicalName
2,6-Dimethyltetrahydro-4h-pyran-4-one
CasNumber
1073-79-6
MolecularFormula
C7H12O2
MolecularWeight
128.169
MdlNumber
MFCD01693965
Smiles
CC1OC(C)CC(=O)C1
Complexity
108
Covalently-bondedUnitCount
1
HeavyAtomCount
9
HydrogenBondAcceptorCount
2
UndefinedAtomStereocenterCount
2
Xlogp3
0.4
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CatalogNumber: AE09411
ChemicalName: 2,6-Dimethyltetrahydro-4h-pyran-4-one
CasNumber: 1073-79-6
MolecularFormula: C7H12O2
MolecularWeight: 128.169
MdlNumber: MFCD01693965
Smiles: CC1OC(C)CC(=O)C1
Complexity: 108
Covalently-bondedUnitCount: 1
HeavyAtomCount: 9
HydrogenBondAcceptorCount: 2
UndefinedAtomStereocenterCount: 2
Xlogp3: 0.4
CatalogNumber:
AE09411
ChemicalName:
2,6-Dimethyltetrahydro-4h-pyran-4-one
CasNumber:
1073-79-6
MolecularFormula:
C7H12O2
MolecularWeight:
128.169
MdlNumber:
MFCD01693965
Smiles:
CC1OC(C)CC(=O)C1
Complexity:
108
Covalently-bondedUnitCount:
1
HeavyAtomCount:
9
HydrogenBondAcceptorCount:
2
UndefinedAtomStereocenterCount:
2
Xlogp3:
0.4
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: OC(=O)C1CC(=O)N(C1)N1CCOCC1
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
UndefinedAtomStereocenterCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
OC(=O)C1CC(=O)N(C1)N1CCOCC1
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
UndefinedAtomStereocenterCount:
__
Xlogp3:
__
CatalogNumber: AE09413
ChemicalName: 4-(1H-Pyrazol-4-yl)benzoic acid
CasNumber: 1017794-47-6
MolecularFormula: C10H8N2O2
MolecularWeight: 188.1827
MdlNumber: MFCD06803014
Smiles: OC(=O)c1ccc(cc1)c1c[nH]nc1
Complexity: 212
Covalently-bondedUnitCount: 1
HeavyAtomCount: 14
HydrogenBondAcceptorCount: 3
UndefinedAtomStereocenterCount: __
Xlogp3: 1.4
CatalogNumber:
AE09413
ChemicalName:
4-(1H-Pyrazol-4-yl)benzoic acid
CasNumber:
1017794-47-6
MolecularFormula:
C10H8N2O2
MolecularWeight:
188.1827
MdlNumber:
MFCD06803014
Smiles:
OC(=O)c1ccc(cc1)c1c[nH]nc1
Complexity:
212
Covalently-bondedUnitCount:
1
HeavyAtomCount:
14
HydrogenBondAcceptorCount:
3
UndefinedAtomStereocenterCount:
__
Xlogp3:
1.4
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: OC(=O)c1ccn2c(n1)ccn2
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
UndefinedAtomStereocenterCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
OC(=O)c1ccn2c(n1)ccn2
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
UndefinedAtomStereocenterCount:
__
Xlogp3:
__