AA78439
156329-62-3 | Methyl 3-cyanobicyclo[1.1.1]pentane-1-carboxylate
Manufacturer: A2B Chem
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CatalogNumber
AA78439
ChemicalName
Methyl 3-cyanobicyclo[1.1.1]pentane-1-carboxylate
CasNumber
156329-62-3
MolecularFormula
C8H9NO2
MolecularWeight
151.1626
MdlNumber
MFCD27664945
Smiles
COC(=O)C12CC(C1)(C2)C#N
Complexity
253
Covalently-bondedUnitCount
1
HeavyAtomCount
11
HydrogenBondAcceptorCount
3
RotatableBondCount
2
Xlogp3
0.1
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CatalogNumber: AA78439
ChemicalName: Methyl 3-cyanobicyclo[1.1.1]pentane-1-carboxylate
CasNumber: 156329-62-3
MolecularFormula: C8H9NO2
MolecularWeight: 151.1626
MdlNumber: MFCD27664945
Smiles: COC(=O)C12CC(C1)(C2)C#N
Complexity: 253
Covalently-bondedUnitCount: 1
HeavyAtomCount: 11
HydrogenBondAcceptorCount: 3
RotatableBondCount: 2
Xlogp3: 0.1
CatalogNumber:
AA78439
ChemicalName:
Methyl 3-cyanobicyclo[1.1.1]pentane-1-carboxylate
CasNumber:
156329-62-3
MolecularFormula:
C8H9NO2
MolecularWeight:
151.1626
MdlNumber:
MFCD27664945
Smiles:
COC(=O)C12CC(C1)(C2)C#N
Complexity:
253
Covalently-bondedUnitCount:
1
HeavyAtomCount:
11
HydrogenBondAcceptorCount:
3
RotatableBondCount:
2
Xlogp3:
0.1
CatalogNumber: __
ChemicalName: __
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MolecularFormula: __
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Smiles: CC(COC(=O)OC1CC(C)CCC1C(C)C)O
Complexity: __
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HydrogenBondAcceptorCount: __
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Xlogp3: __
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Smiles:
CC(COC(=O)OC1CC(C)CCC1C(C)C)O
Complexity:
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Smiles: OCCOC(=O)O[C@@H]1C[C@H](C)CC[C@H]1C(C)C
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Smiles:
OCCOC(=O)O[C@@H]1C[C@H](C)CC[C@H]1C(C)C
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__
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Smiles: FC(C(C(C(F)(F)F)(F)F)(F)F)(CC[Si](CCC(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(Cl)Cl)F
Complexity: __
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MolecularFormula:
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Smiles:
FC(C(C(C(F)(F)F)(F)F)(F)F)(CC[Si](CCC(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(Cl)Cl)F
Complexity:
__
Covalently-bondedUnitCount:
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HeavyAtomCount:
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HydrogenBondAcceptorCount:
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RotatableBondCount:
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Xlogp3:
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