AD59746
1187927-12-3 | (R)-tert-Butyl 3-(chloromethyl)pyrrolidine-1-carboxylate
Manufacturer: A2B Chem
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CatalogNumber
AD59746
ChemicalName
(R)-tert-Butyl 3-(chloromethyl)pyrrolidine-1-carboxylate
CasNumber
1187927-12-3
MolecularFormula
C10H18ClNO2
MolecularWeight
219.7084
MdlNumber
MFCD08059337
Smiles
ClC[C@@H]1CCN(C1)C(=O)OC(C)(C)C
Complexity
213
Covalently-bondedUnitCount
1
DefinedAtomStereocenterCount
1
HeavyAtomCount
14
HydrogenBondAcceptorCount
2
RotatableBondCount
3
Xlogp3
2.1
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CatalogNumber: AD59746
ChemicalName: (R)-tert-Butyl 3-(chloromethyl)pyrrolidine-1-carboxylate
CasNumber: 1187927-12-3
MolecularFormula: C10H18ClNO2
MolecularWeight: 219.7084
MdlNumber: MFCD08059337
Smiles: ClC[C@@H]1CCN(C1)C(=O)OC(C)(C)C
Complexity: 213
Covalently-bondedUnitCount: 1
DefinedAtomStereocenterCount: 1
HeavyAtomCount: 14
HydrogenBondAcceptorCount: 2
RotatableBondCount: 3
Xlogp3: 2.1
CatalogNumber:
AD59746
ChemicalName:
(R)-tert-Butyl 3-(chloromethyl)pyrrolidine-1-carboxylate
CasNumber:
1187927-12-3
MolecularFormula:
C10H18ClNO2
MolecularWeight:
219.7084
MdlNumber:
MFCD08059337
Smiles:
ClC[C@@H]1CCN(C1)C(=O)OC(C)(C)C
Complexity:
213
Covalently-bondedUnitCount:
1
DefinedAtomStereocenterCount:
1
HeavyAtomCount:
14
HydrogenBondAcceptorCount:
2
RotatableBondCount:
3
Xlogp3:
2.1
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Smiles: O=C(OC(C)(C)C)Nc1cc(C)c(cc1Br)C
Complexity: __
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HydrogenBondAcceptorCount: __
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Smiles:
O=C(OC(C)(C)C)Nc1cc(C)c(cc1Br)C
Complexity:
__
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Smiles: c1ccc(cc1)c1nc2ncnn2c(c1)c1ccccc1
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Smiles:
c1ccc(cc1)c1nc2ncnn2c(c1)c1ccccc1
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Smiles: OC(=O)CCc1cn2c(n1)sc(c2)Br.Cl
Complexity: __
Covalently-bondedUnitCount: __
DefinedAtomStereocenterCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
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__
ChemicalName:
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CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
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Smiles:
OC(=O)CCc1cn2c(n1)sc(c2)Br.Cl
Complexity:
__
Covalently-bondedUnitCount:
__
DefinedAtomStereocenterCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__