AB46717
69610-40-8 | N-Boc-L-prolinol
Manufacturer: A2B Chem
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CatalogNumber
AB46717
ChemicalName
N-Boc-L-prolinol
CasNumber
69610-40-8
MolecularFormula
C10H19NO3
MolecularWeight
201.2628
MdlNumber
MFCD00066232
Smiles
OC[C@@H]1CCCN1C(=O)OC(C)(C)C
Complexity
210
Covalently-bondedUnitCount
1
DefinedAtomStereocenterCount
1
HeavyAtomCount
14
HydrogenBondAcceptorCount
3
HydrogenBondDonorCount
1
RotatableBondCount
3
Xlogp3
1
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CatalogNumber: AB46717
ChemicalName: N-Boc-L-prolinol
CasNumber: 69610-40-8
MolecularFormula: C10H19NO3
MolecularWeight: 201.2628
MdlNumber: MFCD00066232
Smiles: OC[C@@H]1CCCN1C(=O)OC(C)(C)C
Complexity: 210
Covalently-bondedUnitCount: 1
DefinedAtomStereocenterCount: 1
HeavyAtomCount: 14
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: 1
RotatableBondCount: 3
Xlogp3: 1
CatalogNumber:
AB46717
ChemicalName:
N-Boc-L-prolinol
CasNumber:
69610-40-8
MolecularFormula:
C10H19NO3
MolecularWeight:
201.2628
MdlNumber:
MFCD00066232
Smiles:
OC[C@@H]1CCCN1C(=O)OC(C)(C)C
Complexity:
210
Covalently-bondedUnitCount:
1
DefinedAtomStereocenterCount:
1
HeavyAtomCount:
14
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
1
RotatableBondCount:
3
Xlogp3:
1
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: O=C(OC(C)(C)C)Nc1cccc(c1)N
Complexity: 223
Covalently-bondedUnitCount: __
DefinedAtomStereocenterCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: 1.3
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
O=C(OC(C)(C)C)Nc1cccc(c1)N
Complexity:
223
Covalently-bondedUnitCount:
__
DefinedAtomStereocenterCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
1.3
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: O=C(OCC1c2ccccc2-c2c1cccc2)NCCCC[C@@H](C(=O)O)NC(=O)OC(C)(C)C
Complexity: 684
Covalently-bondedUnitCount: __
DefinedAtomStereocenterCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: 4.5
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
O=C(OCC1c2ccccc2-c2c1cccc2)NCCCC[C@@H](C(=O)O)NC(=O)OC(C)(C)C
Complexity:
684
Covalently-bondedUnitCount:
__
DefinedAtomStereocenterCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
4.5
CatalogNumber: AB46720
ChemicalName: (S)-L-Boc-His(Trt)-OH
CasNumber: 32926-43-5
MolecularFormula: C30H31N3O4
MolecularWeight: 497.5848
MdlNumber: MFCD00153307
Smiles: OC(=O)C(Cc1ncn(c1)C(c1ccccc1)(c1ccccc1)c1ccccc1)NC(=O)OC(C)(C)C
Complexity: 703
Covalently-bondedUnitCount: 1
DefinedAtomStereocenterCount: 1
HeavyAtomCount: 37
HydrogenBondAcceptorCount: 5
HydrogenBondDonorCount: 2
RotatableBondCount: 10
Xlogp3: 5.4
CatalogNumber:
AB46720
ChemicalName:
(S)-L-Boc-His(Trt)-OH
CasNumber:
32926-43-5
MolecularFormula:
C30H31N3O4
MolecularWeight:
497.5848
MdlNumber:
MFCD00153307
Smiles:
OC(=O)C(Cc1ncn(c1)C(c1ccccc1)(c1ccccc1)c1ccccc1)NC(=O)OC(C)(C)C
Complexity:
703
Covalently-bondedUnitCount:
1
DefinedAtomStereocenterCount:
1
HeavyAtomCount:
37
HydrogenBondAcceptorCount:
5
HydrogenBondDonorCount:
2
RotatableBondCount:
10
Xlogp3:
5.4