AB71438
35264-07-4 | Boc-allo-ile-oh
Manufacturer: A2B Chem
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CatalogNumber
AB71438
ChemicalName
Boc-allo-ile-oh
CasNumber
35264-07-4
MolecularFormula
C11H21NO4
MolecularWeight
231.2887
MdlNumber
MFCD00151905
Smiles
CC[C@H]([C@@H](C(=O)O)NC(=O)OC(C)(C)C)C
Complexity
257
Covalently-bondedUnitCount
1
DefinedAtomStereocenterCount
2
HeavyAtomCount
16
HydrogenBondAcceptorCount
4
HydrogenBondDonorCount
2
RotatableBondCount
6
Xlogp3
1.6
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CatalogNumber: AB71438
ChemicalName: Boc-allo-ile-oh
CasNumber: 35264-07-4
MolecularFormula: C11H21NO4
MolecularWeight: 231.2887
MdlNumber: MFCD00151905
Smiles: CC[C@H]([C@@H](C(=O)O)NC(=O)OC(C)(C)C)C
Complexity: 257
Covalently-bondedUnitCount: 1
DefinedAtomStereocenterCount: 2
HeavyAtomCount: 16
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: 2
RotatableBondCount: 6
Xlogp3: 1.6
CatalogNumber:
AB71438
ChemicalName:
Boc-allo-ile-oh
CasNumber:
35264-07-4
MolecularFormula:
C11H21NO4
MolecularWeight:
231.2887
MdlNumber:
MFCD00151905
Smiles:
CC[C@H]([C@@H](C(=O)O)NC(=O)OC(C)(C)C)C
Complexity:
257
Covalently-bondedUnitCount:
1
DefinedAtomStereocenterCount:
2
HeavyAtomCount:
16
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
2
RotatableBondCount:
6
Xlogp3:
1.6
CatalogNumber: AB71439
ChemicalName: 2-(Boc-amino)isobutyric acid
CasNumber: 30992-29-1
MolecularFormula: C9H17NO4
MolecularWeight: 203.23557999999997
MdlNumber: MFCD00042973
Smiles: O=C(OC(C)(C)C)NC(C(=O)O)(C)C
Complexity: 240
Covalently-bondedUnitCount: 1
DefinedAtomStereocenterCount: __
HeavyAtomCount: 14
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: 2
RotatableBondCount: 4
Xlogp3: 1.1
CatalogNumber:
AB71439
ChemicalName:
2-(Boc-amino)isobutyric acid
CasNumber:
30992-29-1
MolecularFormula:
C9H17NO4
MolecularWeight:
203.23557999999997
MdlNumber:
MFCD00042973
Smiles:
O=C(OC(C)(C)C)NC(C(=O)O)(C)C
Complexity:
240
Covalently-bondedUnitCount:
1
DefinedAtomStereocenterCount:
__
HeavyAtomCount:
14
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
2
RotatableBondCount:
4
Xlogp3:
1.1
CatalogNumber: AB71440
ChemicalName: Boc-Arg-OH HCl
CasNumber: 35897-34-8
MolecularFormula: C11H23ClN4O4
MolecularWeight: 310.7777
MdlNumber: MFCD00065552
Smiles: OC(=O)[C@@H](NC(=O)OC(C)(C)C)CCCNC(=N)N.Cl
Complexity: 345
Covalently-bondedUnitCount: 2
DefinedAtomStereocenterCount: 1
HeavyAtomCount: 20
HydrogenBondAcceptorCount: 5
HydrogenBondDonorCount: 5
RotatableBondCount: 8
Xlogp3: __
CatalogNumber:
AB71440
ChemicalName:
Boc-Arg-OH HCl
CasNumber:
35897-34-8
MolecularFormula:
C11H23ClN4O4
MolecularWeight:
310.7777
MdlNumber:
MFCD00065552
Smiles:
OC(=O)[C@@H](NC(=O)OC(C)(C)C)CCCNC(=N)N.Cl
Complexity:
345
Covalently-bondedUnitCount:
2
DefinedAtomStereocenterCount:
1
HeavyAtomCount:
20
HydrogenBondAcceptorCount:
5
HydrogenBondDonorCount:
5
RotatableBondCount:
8
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: N=C(NS(=O)(=O)c1c(C)cc(cc1C)C)NCCC[C@@H](C(=O)O)NC(=O)OC(C)(C)C.NC1CCCCC1
Complexity: __
Covalently-bondedUnitCount: __
DefinedAtomStereocenterCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
N=C(NS(=O)(=O)c1c(C)cc(cc1C)C)NCCC[C@@H](C(=O)O)NC(=O)OC(C)(C)C.NC1CCCCC1
Complexity:
__
Covalently-bondedUnitCount:
__
DefinedAtomStereocenterCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__