AA42133
127095-92-5 | Boc-D-Cha-OH
Manufacturer: A2B Chem
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CatalogNumber
AA42133
ChemicalName
Boc-D-Cha-OH
CasNumber
127095-92-5
MolecularFormula
C14H25NO4
MolecularWeight
271.3526
MdlNumber
MFCD00133627
Smiles
OC(=O)[C@H](NC(=O)OC(C)(C)C)CC1CCCCC1
Complexity
316
Covalently-bondedUnitCount
1
DefinedAtomStereocenterCount
1
HeavyAtomCount
19
HydrogenBondAcceptorCount
4
HydrogenBondDonorCount
2
RotatableBondCount
6
Xlogp3
3.7
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CatalogNumber: AA42133
ChemicalName: Boc-D-Cha-OH
CasNumber: 127095-92-5
MolecularFormula: C14H25NO4
MolecularWeight: 271.3526
MdlNumber: MFCD00133627
Smiles: OC(=O)[C@H](NC(=O)OC(C)(C)C)CC1CCCCC1
Complexity: 316
Covalently-bondedUnitCount: 1
DefinedAtomStereocenterCount: 1
HeavyAtomCount: 19
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: 2
RotatableBondCount: 6
Xlogp3: 3.7
CatalogNumber:
AA42133
ChemicalName:
Boc-D-Cha-OH
CasNumber:
127095-92-5
MolecularFormula:
C14H25NO4
MolecularWeight:
271.3526
MdlNumber:
MFCD00133627
Smiles:
OC(=O)[C@H](NC(=O)OC(C)(C)C)CC1CCCCC1
Complexity:
316
Covalently-bondedUnitCount:
1
DefinedAtomStereocenterCount:
1
HeavyAtomCount:
19
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
2
RotatableBondCount:
6
Xlogp3:
3.7
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: [cH-]1cccc1.CCCC(=O)[c-]1cccc1.[Fe+2]
Complexity: __
Covalently-bondedUnitCount: __
DefinedAtomStereocenterCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
[cH-]1cccc1.CCCC(=O)[c-]1cccc1.[Fe+2]
Complexity:
__
Covalently-bondedUnitCount:
__
DefinedAtomStereocenterCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: [cH-]1cccc1.CN(C[c-]1cccc1)C.[Fe+2]
Complexity: __
Covalently-bondedUnitCount: __
DefinedAtomStereocenterCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
[cH-]1cccc1.CN(C[c-]1cccc1)C.[Fe+2]
Complexity:
__
Covalently-bondedUnitCount:
__
DefinedAtomStereocenterCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: [CH]1C=CC=C1.[CH]1C=CC=C1.[Ti].[CH3].[CH3]
Complexity: __
Covalently-bondedUnitCount: __
DefinedAtomStereocenterCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
[CH]1C=CC=C1.[CH]1C=CC=C1.[Ti].[CH3].[CH3]
Complexity:
__
Covalently-bondedUnitCount:
__
DefinedAtomStereocenterCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__