AG69462
614730-96-0 | tert-Butyl 4-cyano-4-(hydroxymethyl)piperidine-1-carboxylate
Manufacturer: A2B Chem
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CatalogNumber
AG69462
ChemicalName
tert-Butyl 4-cyano-4-(hydroxymethyl)piperidine-1-carboxylate
CasNumber
614730-96-0
MolecularFormula
C12H20N2O3
MolecularWeight
240.2988
MdlNumber
MFCD11877842
Smiles
OCC1(CCN(CC1)C(=O)OC(C)(C)C)C#N
Complexity
329
Covalently-bondedUnitCount
1
HeavyAtomCount
17
HydrogenBondAcceptorCount
4
HydrogenBondDonorCount
1
RotatableBondCount
3
Xlogp3
0.5
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CatalogNumber: AG69462
ChemicalName: tert-Butyl 4-cyano-4-(hydroxymethyl)piperidine-1-carboxylate
CasNumber: 614730-96-0
MolecularFormula: C12H20N2O3
MolecularWeight: 240.2988
MdlNumber: MFCD11877842
Smiles: OCC1(CCN(CC1)C(=O)OC(C)(C)C)C#N
Complexity: 329
Covalently-bondedUnitCount: 1
HeavyAtomCount: 17
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: 1
RotatableBondCount: 3
Xlogp3: 0.5
CatalogNumber:
AG69462
ChemicalName:
tert-Butyl 4-cyano-4-(hydroxymethyl)piperidine-1-carboxylate
CasNumber:
614730-96-0
MolecularFormula:
C12H20N2O3
MolecularWeight:
240.2988
MdlNumber:
MFCD11877842
Smiles:
OCC1(CCN(CC1)C(=O)OC(C)(C)C)C#N
Complexity:
329
Covalently-bondedUnitCount:
1
HeavyAtomCount:
17
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
1
RotatableBondCount:
3
Xlogp3:
0.5
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Smiles: CCCCCCCCN1C(=O)c2c(C1=O)c(sc2Br)Br
Complexity: __
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CCCCCCCCN1C(=O)c2c(C1=O)c(sc2Br)Br
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Smiles: COc1cc(Cl)ncc1[N+](=O)[O-]
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Smiles:
COc1cc(Cl)ncc1[N+](=O)[O-]
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HydrogenBondAcceptorCount:
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HydrogenBondDonorCount:
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RotatableBondCount:
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