AB06184
205445-51-8 | Boc-D-3,4-difluorophenylalanine
Manufacturer: A2B Chem
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CatalogNumber
AB06184
ChemicalName
Boc-D-3,4-difluorophenylalanine
CasNumber
205445-51-8
MolecularFormula
C14H17F2NO4
MolecularWeight
301.2859
MdlNumber
MFCD00672519
Smiles
O=C(OC(C)(C)C)N[C@@H](C(=O)O)Cc1ccc(c(c1)F)F
Complexity
384
Covalently-bondedUnitCount
1
DefinedAtomStereocenterCount
1
HeavyAtomCount
21
HydrogenBondAcceptorCount
6
HydrogenBondDonorCount
2
RotatableBondCount
6
Xlogp3
2.7
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CatalogNumber: AB06184
ChemicalName: Boc-D-3,4-difluorophenylalanine
CasNumber: 205445-51-8
MolecularFormula: C14H17F2NO4
MolecularWeight: 301.2859
MdlNumber: MFCD00672519
Smiles: O=C(OC(C)(C)C)N[C@@H](C(=O)O)Cc1ccc(c(c1)F)F
Complexity: 384
Covalently-bondedUnitCount: 1
DefinedAtomStereocenterCount: 1
HeavyAtomCount: 21
HydrogenBondAcceptorCount: 6
HydrogenBondDonorCount: 2
RotatableBondCount: 6
Xlogp3: 2.7
CatalogNumber:
AB06184
ChemicalName:
Boc-D-3,4-difluorophenylalanine
CasNumber:
205445-51-8
MolecularFormula:
C14H17F2NO4
MolecularWeight:
301.2859
MdlNumber:
MFCD00672519
Smiles:
O=C(OC(C)(C)C)N[C@@H](C(=O)O)Cc1ccc(c(c1)F)F
Complexity:
384
Covalently-bondedUnitCount:
1
DefinedAtomStereocenterCount:
1
HeavyAtomCount:
21
HydrogenBondAcceptorCount:
6
HydrogenBondDonorCount:
2
RotatableBondCount:
6
Xlogp3:
2.7
CatalogNumber: AB06185
ChemicalName: 2-Chloro-4-iodo-6-(trifluoromethyl)pyridine
CasNumber: 205444-22-0
MolecularFormula: C6H2ClF3IN
MolecularWeight: 307.4395
MdlNumber: MFCD10699394
Smiles: Ic1cc(Cl)nc(c1)C(F)(F)F
Complexity: 163
Covalently-bondedUnitCount: 1
DefinedAtomStereocenterCount: __
HeavyAtomCount: 12
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: 3.4
CatalogNumber:
AB06185
ChemicalName:
2-Chloro-4-iodo-6-(trifluoromethyl)pyridine
CasNumber:
205444-22-0
MolecularFormula:
C6H2ClF3IN
MolecularWeight:
307.4395
MdlNumber:
MFCD10699394
Smiles:
Ic1cc(Cl)nc(c1)C(F)(F)F
Complexity:
163
Covalently-bondedUnitCount:
1
DefinedAtomStereocenterCount:
__
HeavyAtomCount:
12
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
3.4
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: [2H]c1c([2H])c([2H])c2c(c1[2H])c1c([2H])c([2H])c(c3c1c1c2c([2H])c([2H])c(c1c(c3[2H])[2H])[2H])[2H]
Complexity: __
Covalently-bondedUnitCount: __
DefinedAtomStereocenterCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
[2H]c1c([2H])c([2H])c2c(c1[2H])c1c([2H])c([2H])c(c3c1c1c2c([2H])c([2H])c(c1c(c3[2H])[2H])[2H])[2H]
Complexity:
__
Covalently-bondedUnitCount:
__
DefinedAtomStereocenterCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: AB06189
ChemicalName: 1-Boc-2-hydroxymethyl-piperazine
CasNumber: 205434-75-9
MolecularFormula: C10H20N2O3
MolecularWeight: 216.2774
MdlNumber: MFCD07772091
Smiles: OCC1CNCCN1C(=O)OC(C)(C)C
Complexity: 225
Covalently-bondedUnitCount: 1
DefinedAtomStereocenterCount: __
HeavyAtomCount: 15
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: 2
RotatableBondCount: 3
Xlogp3: -0.2
CatalogNumber:
AB06189
ChemicalName:
1-Boc-2-hydroxymethyl-piperazine
CasNumber:
205434-75-9
MolecularFormula:
C10H20N2O3
MolecularWeight:
216.2774
MdlNumber:
MFCD07772091
Smiles:
OCC1CNCCN1C(=O)OC(C)(C)C
Complexity:
225
Covalently-bondedUnitCount:
1
DefinedAtomStereocenterCount:
__
HeavyAtomCount:
15
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
2
RotatableBondCount:
3
Xlogp3:
-0.2