AB71418
706806-61-3 | Boc-(S)-alpha-benzyl-proline
Manufacturer: A2B Chem
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CatalogNumber
AB71418
ChemicalName
Boc-(S)-alpha-benzyl-proline
CasNumber
706806-61-3
MolecularFormula
C17H23NO4
MolecularWeight
305.3688
MdlNumber
MFCD06659153
Smiles
O=C(N1CCC[C@]1(Cc1ccccc1)C(=O)O)OC(C)(C)C
Complexity
423
Covalently-bondedUnitCount
1
DefinedAtomStereocenterCount
1
HeavyAtomCount
22
HydrogenBondAcceptorCount
4
HydrogenBondDonorCount
1
RotatableBondCount
5
Xlogp3
3
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CatalogNumber: AB71418
ChemicalName: Boc-(S)-alpha-benzyl-proline
CasNumber: 706806-61-3
MolecularFormula: C17H23NO4
MolecularWeight: 305.3688
MdlNumber: MFCD06659153
Smiles: O=C(N1CCC[C@]1(Cc1ccccc1)C(=O)O)OC(C)(C)C
Complexity: 423
Covalently-bondedUnitCount: 1
DefinedAtomStereocenterCount: 1
HeavyAtomCount: 22
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: 1
RotatableBondCount: 5
Xlogp3: 3
CatalogNumber:
AB71418
ChemicalName:
Boc-(S)-alpha-benzyl-proline
CasNumber:
706806-61-3
MolecularFormula:
C17H23NO4
MolecularWeight:
305.3688
MdlNumber:
MFCD06659153
Smiles:
O=C(N1CCC[C@]1(Cc1ccccc1)C(=O)O)OC(C)(C)C
Complexity:
423
Covalently-bondedUnitCount:
1
DefinedAtomStereocenterCount:
1
HeavyAtomCount:
22
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
1
RotatableBondCount:
5
Xlogp3:
3
CatalogNumber: AB71419
ChemicalName: Boc-cis-2-aminocyclohexanecarboxylic acid
CasNumber: 63216-49-9
MolecularFormula: C12H21NO4
MolecularWeight: 243.2994
MdlNumber: MFCD01863244
Smiles: O=C(OC(C)(C)C)N[C@H]1CCCC[C@H]1C(=O)O
Complexity: 295
Covalently-bondedUnitCount: 1
DefinedAtomStereocenterCount: 2
HeavyAtomCount: 17
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: 2
RotatableBondCount: 4
Xlogp3: 2.5
CatalogNumber:
AB71419
ChemicalName:
Boc-cis-2-aminocyclohexanecarboxylic acid
CasNumber:
63216-49-9
MolecularFormula:
C12H21NO4
MolecularWeight:
243.2994
MdlNumber:
MFCD01863244
Smiles:
O=C(OC(C)(C)C)N[C@H]1CCCC[C@H]1C(=O)O
Complexity:
295
Covalently-bondedUnitCount:
1
DefinedAtomStereocenterCount:
2
HeavyAtomCount:
17
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
2
RotatableBondCount:
4
Xlogp3:
2.5
CatalogNumber: AB71420
ChemicalName: Boc-1,4-trans-ACHC-OH
CasNumber: 53292-89-0
MolecularFormula: C12H21NO4
MolecularWeight: 243.29944000000003
MdlNumber: MFCD01862293
Smiles: O=C(OC(C)(C)C)N[C@@H]1CC[C@H](CC1)C(=O)O
Complexity: 287
Covalently-bondedUnitCount: 1
DefinedAtomStereocenterCount: __
HeavyAtomCount: 17
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: 2
RotatableBondCount: 4
Xlogp3: 1.7
CatalogNumber:
AB71420
ChemicalName:
Boc-1,4-trans-ACHC-OH
CasNumber:
53292-89-0
MolecularFormula:
C12H21NO4
MolecularWeight:
243.29944000000003
MdlNumber:
MFCD01862293
Smiles:
O=C(OC(C)(C)C)N[C@@H]1CC[C@H](CC1)C(=O)O
Complexity:
287
Covalently-bondedUnitCount:
1
DefinedAtomStereocenterCount:
__
HeavyAtomCount:
17
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
2
RotatableBondCount:
4
Xlogp3:
1.7
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: OC(=O)CCCCCCCCCCNC(=O)OC(C)(C)C
Complexity: 297
Covalently-bondedUnitCount: __
DefinedAtomStereocenterCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: 4.2
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
OC(=O)CCCCCCCCCCNC(=O)OC(C)(C)C
Complexity:
297
Covalently-bondedUnitCount:
__
DefinedAtomStereocenterCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
4.2