AA01325
10018-78-7 | 4-(Cyclohexyloxy)-4-oxobutanoic acid
Manufacturer: A2B Chem
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CatalogNumber
AA01325
ChemicalName
4-(Cyclohexyloxy)-4-oxobutanoic acid
CasNumber
10018-78-7
MolecularFormula
C10H16O4
MolecularWeight
200.2316
MdlNumber
MFCD00785959
Smiles
O=C(OC1CCCCC1)CCC(=O)O
Complexity
206
Covalently-bondedUnitCount
1
HeavyAtomCount
14
HydrogenBondAcceptorCount
4
HydrogenBondDonorCount
1
RotatableBondCount
5
Xlogp3
1.4
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CatalogNumber: AA01325
ChemicalName: 4-(Cyclohexyloxy)-4-oxobutanoic acid
CasNumber: 10018-78-7
MolecularFormula: C10H16O4
MolecularWeight: 200.2316
MdlNumber: MFCD00785959
Smiles: O=C(OC1CCCCC1)CCC(=O)O
Complexity: 206
Covalently-bondedUnitCount: 1
HeavyAtomCount: 14
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: 1
RotatableBondCount: 5
Xlogp3: 1.4
CatalogNumber:
AA01325
ChemicalName:
4-(Cyclohexyloxy)-4-oxobutanoic acid
CasNumber:
10018-78-7
MolecularFormula:
C10H16O4
MolecularWeight:
200.2316
MdlNumber:
MFCD00785959
Smiles:
O=C(OC1CCCCC1)CCC(=O)O
Complexity:
206
Covalently-bondedUnitCount:
1
HeavyAtomCount:
14
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
1
RotatableBondCount:
5
Xlogp3:
1.4
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
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Smiles: O=C(Nc1ccc(cc1C)N=Nc1cc2c(c(c1)S(=O)(=O)O)cccc2S(=O)(=O)O)Nc1ccc(cc1C)N=Nc1cc2c(c(c1)S(=O)(=O)O)cccc2S(=O)(=O)O
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
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Smiles:
O=C(Nc1ccc(cc1C)N=Nc1cc2c(c(c1)S(=O)(=O)O)cccc2S(=O)(=O)O)Nc1ccc(cc1C)N=Nc1cc2c(c(c1)S(=O)(=O)O)cccc2S(=O)(=O)O
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
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ChemicalName: __
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Smiles: COc1c2C=[N+](C)CCc2cc2c1OCO2.[Cl-]
Complexity: __
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HeavyAtomCount: __
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Xlogp3: __
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MolecularFormula:
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MolecularWeight:
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Smiles:
COc1c2C=[N+](C)CCc2cc2c1OCO2.[Cl-]
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
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Smiles: CCc1ccncc1B(O)O
Complexity: __
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HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
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Xlogp3: __
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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:
CCc1ccncc1B(O)O
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__