AA84691
16286-86-5 | 3-Hydroxy-3-methylcyclobutanecarboxylic acid
Manufacturer: A2B Chem
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CatalogNumber
AA84691
ChemicalName
3-Hydroxy-3-methylcyclobutanecarboxylic acid
CasNumber
16286-86-5
MolecularFormula
C6H10O3
MolecularWeight
130.1418
MdlNumber
MFCD13659411
Smiles
OC(=O)C1CC(C1)(C)O
Complexity
135
Covalently-bondedUnitCount
1
HeavyAtomCount
9
HydrogenBondAcceptorCount
3
HydrogenBondDonorCount
2
RotatableBondCount
1
Xlogp3
-0.2
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CatalogNumber: AA84691
ChemicalName: 3-Hydroxy-3-methylcyclobutanecarboxylic acid
CasNumber: 16286-86-5
MolecularFormula: C6H10O3
MolecularWeight: 130.1418
MdlNumber: MFCD13659411
Smiles: OC(=O)C1CC(C1)(C)O
Complexity: 135
Covalently-bondedUnitCount: 1
HeavyAtomCount: 9
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: 2
RotatableBondCount: 1
Xlogp3: -0.2
CatalogNumber:
AA84691
ChemicalName:
3-Hydroxy-3-methylcyclobutanecarboxylic acid
CasNumber:
16286-86-5
MolecularFormula:
C6H10O3
MolecularWeight:
130.1418
MdlNumber:
MFCD13659411
Smiles:
OC(=O)C1CC(C1)(C)O
Complexity:
135
Covalently-bondedUnitCount:
1
HeavyAtomCount:
9
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
2
RotatableBondCount:
1
Xlogp3:
-0.2
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: N[C@@H]1CCO[C@@H](C1)C
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
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MolecularFormula:
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MolecularWeight:
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MdlNumber:
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Smiles:
N[C@@H]1CCO[C@@H](C1)C
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
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RotatableBondCount:
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Xlogp3:
__
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ChemicalName: __
CasNumber: __
MolecularFormula: __
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Smiles: Clc1ccc(cc1)Nc1ccc(cc1Br)CS(=O)(=O)C
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
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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Smiles:
Clc1ccc(cc1)Nc1ccc(cc1Br)CS(=O)(=O)C
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
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ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: C[C@@H](c1ncc(c(c1)C)Br)N.Cl
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
C[C@@H](c1ncc(c(c1)C)Br)N.Cl
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__