AB75120
45120-30-7 | H-Glu-OtBu
Manufacturer: A2B Chem
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CatalogNumber
AB75120
ChemicalName
H-Glu-OtBu
CasNumber
45120-30-7
MolecularFormula
C9H17NO4
MolecularWeight
203.2356
MdlNumber
MFCD00038562
Smiles
N[C@H](C(=O)OC(C)(C)C)CCC(=O)O
Complexity
219
Covalently-bondedUnitCount
1
DefinedAtomStereocenterCount
1
HeavyAtomCount
14
HydrogenBondAcceptorCount
5
HydrogenBondDonorCount
2
RotatableBondCount
6
Xlogp3
-2.2
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CatalogNumber: AB75120
ChemicalName: H-Glu-OtBu
CasNumber: 45120-30-7
MolecularFormula: C9H17NO4
MolecularWeight: 203.2356
MdlNumber: MFCD00038562
Smiles: N[C@H](C(=O)OC(C)(C)C)CCC(=O)O
Complexity: 219
Covalently-bondedUnitCount: 1
DefinedAtomStereocenterCount: 1
HeavyAtomCount: 14
HydrogenBondAcceptorCount: 5
HydrogenBondDonorCount: 2
RotatableBondCount: 6
Xlogp3: -2.2
CatalogNumber:
AB75120
ChemicalName:
H-Glu-OtBu
CasNumber:
45120-30-7
MolecularFormula:
C9H17NO4
MolecularWeight:
203.2356
MdlNumber:
MFCD00038562
Smiles:
N[C@H](C(=O)OC(C)(C)C)CCC(=O)O
Complexity:
219
Covalently-bondedUnitCount:
1
DefinedAtomStereocenterCount:
1
HeavyAtomCount:
14
HydrogenBondAcceptorCount:
5
HydrogenBondDonorCount:
2
RotatableBondCount:
6
Xlogp3:
-2.2
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: OC[C@@H]([C@H]([C@@H]([C@@H](C=O)O)O)O)O
Complexity: __
Covalently-bondedUnitCount: __
DefinedAtomStereocenterCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
OC[C@@H]([C@H]([C@@H]([C@@H](C=O)O)O)O)O
Complexity:
__
Covalently-bondedUnitCount:
__
DefinedAtomStereocenterCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: AB75122
ChemicalName: H-His-NH2 2HCl
CasNumber: 71666-95-0
MolecularFormula: C6H12Cl2N4O
MolecularWeight: 227.0917
MdlNumber: MFCD00058559
Smiles: N[C@H](C(=O)N)Cc1cnc[nH]1.Cl.Cl
Complexity: 150
Covalently-bondedUnitCount: 3
DefinedAtomStereocenterCount: 1
HeavyAtomCount: 13
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: 5
RotatableBondCount: 3
Xlogp3: __
CatalogNumber:
AB75122
ChemicalName:
H-His-NH2 2HCl
CasNumber:
71666-95-0
MolecularFormula:
C6H12Cl2N4O
MolecularWeight:
227.0917
MdlNumber:
MFCD00058559
Smiles:
N[C@H](C(=O)N)Cc1cnc[nH]1.Cl.Cl
Complexity:
150
Covalently-bondedUnitCount:
3
DefinedAtomStereocenterCount:
1
HeavyAtomCount:
13
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
5
RotatableBondCount:
3
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: N[C@H](C(=O)O)Cc1c[nH]cn1
Complexity: 151
Covalently-bondedUnitCount: __
DefinedAtomStereocenterCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: -3.2
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
N[C@H](C(=O)O)Cc1c[nH]cn1
Complexity:
151
Covalently-bondedUnitCount:
__
DefinedAtomStereocenterCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
-3.2