AD54076
28114-87-6 | Spiro[3.3]heptane-2-carboxylic acid
Manufacturer: A2B Chem
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CatalogNumber
AD54076
ChemicalName
Spiro[3.3]heptane-2-carboxylic acid
CasNumber
28114-87-6
MolecularFormula
C8H12O2
MolecularWeight
140.1797
MdlNumber
MFCD19228416
Smiles
OC(=O)C1CC2(C1)CCC2
Complexity
162
Covalently-bondedUnitCount
1
HeavyAtomCount
10
HydrogenBondAcceptorCount
2
HydrogenBondDonorCount
1
RotatableBondCount
1
Xlogp3
1.8
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CatalogNumber: AD54076
ChemicalName: Spiro[3.3]heptane-2-carboxylic acid
CasNumber: 28114-87-6
MolecularFormula: C8H12O2
MolecularWeight: 140.1797
MdlNumber: MFCD19228416
Smiles: OC(=O)C1CC2(C1)CCC2
Complexity: 162
Covalently-bondedUnitCount: 1
HeavyAtomCount: 10
HydrogenBondAcceptorCount: 2
HydrogenBondDonorCount: 1
RotatableBondCount: 1
Xlogp3: 1.8
CatalogNumber:
AD54076
ChemicalName:
Spiro[3.3]heptane-2-carboxylic acid
CasNumber:
28114-87-6
MolecularFormula:
C8H12O2
MolecularWeight:
140.1797
MdlNumber:
MFCD19228416
Smiles:
OC(=O)C1CC2(C1)CCC2
Complexity:
162
Covalently-bondedUnitCount:
1
HeavyAtomCount:
10
HydrogenBondAcceptorCount:
2
HydrogenBondDonorCount:
1
RotatableBondCount:
1
Xlogp3:
1.8
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: O=Nc1c(nc2n1cccn2)c1ccccc1
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
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__
ChemicalName:
__
CasNumber:
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MolecularFormula:
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MdlNumber:
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Smiles:
O=Nc1c(nc2n1cccn2)c1ccccc1
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
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ChemicalName: __
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MolecularFormula: __
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Smiles: CC(C(=O)O)COc1ccc(cc1)Cl.OCCN(C)C
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
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__
ChemicalName:
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CasNumber:
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MolecularFormula:
__
MolecularWeight:
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MdlNumber:
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Smiles:
CC(C(=O)O)COc1ccc(cc1)Cl.OCCN(C)C
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
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MolecularFormula: __
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Smiles: Clc1ccc2c(c1)c1CSCCc1[nH]2
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
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CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
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Smiles:
Clc1ccc2c(c1)c1CSCCc1[nH]2
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__