AA52128
133174-15-9 | Fmoc-Cit-OH
Manufacturer: A2B Chem
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CatalogNumber
AA52128
ChemicalName
Fmoc-Cit-OH
CasNumber
133174-15-9
MolecularFormula
C21H23N3O5
MolecularWeight
397.4244
MdlNumber
MFCD00151943
Smiles
NC(=O)NCCC[C@@H](C(=O)O)NC(=O)OCC1c2ccccc2-c2c1cccc2
Complexity
577
Covalently-bondedUnitCount
1
DefinedAtomStereocenterCount
1
HeavyAtomCount
29
HydrogenBondAcceptorCount
5
HydrogenBondDonorCount
4
RotatableBondCount
9
Xlogp3
2.1
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CatalogNumber: AA52128
ChemicalName: Fmoc-Cit-OH
CasNumber: 133174-15-9
MolecularFormula: C21H23N3O5
MolecularWeight: 397.4244
MdlNumber: MFCD00151943
Smiles: NC(=O)NCCC[C@@H](C(=O)O)NC(=O)OCC1c2ccccc2-c2c1cccc2
Complexity: 577
Covalently-bondedUnitCount: 1
DefinedAtomStereocenterCount: 1
HeavyAtomCount: 29
HydrogenBondAcceptorCount: 5
HydrogenBondDonorCount: 4
RotatableBondCount: 9
Xlogp3: 2.1
CatalogNumber:
AA52128
ChemicalName:
Fmoc-Cit-OH
CasNumber:
133174-15-9
MolecularFormula:
C21H23N3O5
MolecularWeight:
397.4244
MdlNumber:
MFCD00151943
Smiles:
NC(=O)NCCC[C@@H](C(=O)O)NC(=O)OCC1c2ccccc2-c2c1cccc2
Complexity:
577
Covalently-bondedUnitCount:
1
DefinedAtomStereocenterCount:
1
HeavyAtomCount:
29
HydrogenBondAcceptorCount:
5
HydrogenBondDonorCount:
4
RotatableBondCount:
9
Xlogp3:
2.1
CatalogNumber: AA52129
ChemicalName: H-D-Val-NH2 HCl
CasNumber: 133170-58-8
MolecularFormula: C5H13ClN2O
MolecularWeight: 152.6225
MdlNumber: MFCD00270619
Smiles: N[C@@H](C(=O)N)C(C)C.Cl
Complexity: 90.4
Covalently-bondedUnitCount: 2
DefinedAtomStereocenterCount: 1
HeavyAtomCount: 9
HydrogenBondAcceptorCount: 2
HydrogenBondDonorCount: 3
RotatableBondCount: 2
Xlogp3: __
CatalogNumber:
AA52129
ChemicalName:
H-D-Val-NH2 HCl
CasNumber:
133170-58-8
MolecularFormula:
C5H13ClN2O
MolecularWeight:
152.6225
MdlNumber:
MFCD00270619
Smiles:
N[C@@H](C(=O)N)C(C)C.Cl
Complexity:
90.4
Covalently-bondedUnitCount:
2
DefinedAtomStereocenterCount:
1
HeavyAtomCount:
9
HydrogenBondAcceptorCount:
2
HydrogenBondDonorCount:
3
RotatableBondCount:
2
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: OC1CC2CC1C1C2C(C(C1)O)O
Complexity: __
Covalently-bondedUnitCount: __
DefinedAtomStereocenterCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
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CasNumber:
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MolecularFormula:
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MolecularWeight:
__
MdlNumber:
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Smiles:
OC1CC2CC1C1C2C(C(C1)O)O
Complexity:
__
Covalently-bondedUnitCount:
__
DefinedAtomStereocenterCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: [O-]C(=O)C(=O)OCCCC
Complexity: __
Covalently-bondedUnitCount: __
DefinedAtomStereocenterCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
[O-]C(=O)C(=O)OCCCC
Complexity:
__
Covalently-bondedUnitCount:
__
DefinedAtomStereocenterCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__