AB47071
170491-63-1 | 2-Hydroxymethyl-pyrrolidine-1-carboxylic acid tert-butyl ester
Manufacturer: A2B Chem
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CatalogNumber
AB47071
ChemicalName
2-Hydroxymethyl-pyrrolidine-1-carboxylic acid tert-butyl ester
CasNumber
170491-63-1
MolecularFormula
C10H19NO3
MolecularWeight
201.2628
MdlNumber
MFCD01456556
Smiles
OCC1CCCN1C(=O)OC(C)(C)C
Complexity
210
Covalently-bondedUnitCount
1
HeavyAtomCount
14
HydrogenBondAcceptorCount
3
HydrogenBondDonorCount
1
RotatableBondCount
3
UndefinedAtomStereocenterCount
1
Xlogp3
1
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CatalogNumber: AB47071
ChemicalName: 2-Hydroxymethyl-pyrrolidine-1-carboxylic acid tert-butyl ester
CasNumber: 170491-63-1
MolecularFormula: C10H19NO3
MolecularWeight: 201.2628
MdlNumber: MFCD01456556
Smiles: OCC1CCCN1C(=O)OC(C)(C)C
Complexity: 210
Covalently-bondedUnitCount: 1
HeavyAtomCount: 14
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: 1
RotatableBondCount: 3
UndefinedAtomStereocenterCount: 1
Xlogp3: 1
CatalogNumber:
AB47071
ChemicalName:
2-Hydroxymethyl-pyrrolidine-1-carboxylic acid tert-butyl ester
CasNumber:
170491-63-1
MolecularFormula:
C10H19NO3
MolecularWeight:
201.2628
MdlNumber:
MFCD01456556
Smiles:
OCC1CCCN1C(=O)OC(C)(C)C
Complexity:
210
Covalently-bondedUnitCount:
1
HeavyAtomCount:
14
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
1
RotatableBondCount:
3
UndefinedAtomStereocenterCount:
1
Xlogp3:
1
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: O=C(C=P(c1ccccc1)(c1ccccc1)c1ccccc1)OC(C)(C)C
Complexity: 475
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
UndefinedAtomStereocenterCount: __
Xlogp3: 5
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
O=C(C=P(c1ccccc1)(c1ccccc1)c1ccccc1)OC(C)(C)C
Complexity:
475
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
UndefinedAtomStereocenterCount:
__
Xlogp3:
5
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: BrCCCNC(=O)OC(C)(C)C
Complexity: 143
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
UndefinedAtomStereocenterCount: __
Xlogp3: 2
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
BrCCCNC(=O)OC(C)(C)C
Complexity:
143
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
UndefinedAtomStereocenterCount:
__
Xlogp3:
2
CatalogNumber: AB47075
ChemicalName: 1-Boc-3-hydroxyazetidine
CasNumber: 141699-55-0
MolecularFormula: C8H15NO3
MolecularWeight: 173.2096
MdlNumber: MFCD04115305
Smiles: OC1CN(C1)C(=O)OC(C)(C)C
Complexity: 179
Covalently-bondedUnitCount: 1
HeavyAtomCount: 12
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: 1
RotatableBondCount: 2
UndefinedAtomStereocenterCount: __
Xlogp3: 0.3
CatalogNumber:
AB47075
ChemicalName:
1-Boc-3-hydroxyazetidine
CasNumber:
141699-55-0
MolecularFormula:
C8H15NO3
MolecularWeight:
173.2096
MdlNumber:
MFCD04115305
Smiles:
OC1CN(C1)C(=O)OC(C)(C)C
Complexity:
179
Covalently-bondedUnitCount:
1
HeavyAtomCount:
12
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
1
RotatableBondCount:
2
UndefinedAtomStereocenterCount:
__
Xlogp3:
0.3