AB52297
80445-78-9 | Boc-D-Dab-OH
Manufacturer: A2B Chem
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CatalogNumber
AB52297
ChemicalName
Boc-D-Dab-OH
CasNumber
80445-78-9
MolecularFormula
C9H18N2O4
MolecularWeight
218.2502
MdlNumber
MFCD00798622
Smiles
NCC[C@H](C(=O)O)NC(=O)OC(C)(C)C
Complexity
235
Covalently-bondedUnitCount
1
DefinedAtomStereocenterCount
1
HeavyAtomCount
15
HydrogenBondAcceptorCount
5
HydrogenBondDonorCount
3
RotatableBondCount
6
Xlogp3
-2.3
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CatalogNumber: AB52297
ChemicalName: Boc-D-Dab-OH
CasNumber: 80445-78-9
MolecularFormula: C9H18N2O4
MolecularWeight: 218.2502
MdlNumber: MFCD00798622
Smiles: NCC[C@H](C(=O)O)NC(=O)OC(C)(C)C
Complexity: 235
Covalently-bondedUnitCount: 1
DefinedAtomStereocenterCount: 1
HeavyAtomCount: 15
HydrogenBondAcceptorCount: 5
HydrogenBondDonorCount: 3
RotatableBondCount: 6
Xlogp3: -2.3
CatalogNumber:
AB52297
ChemicalName:
Boc-D-Dab-OH
CasNumber:
80445-78-9
MolecularFormula:
C9H18N2O4
MolecularWeight:
218.2502
MdlNumber:
MFCD00798622
Smiles:
NCC[C@H](C(=O)O)NC(=O)OC(C)(C)C
Complexity:
235
Covalently-bondedUnitCount:
1
DefinedAtomStereocenterCount:
1
HeavyAtomCount:
15
HydrogenBondAcceptorCount:
5
HydrogenBondDonorCount:
3
RotatableBondCount:
6
Xlogp3:
-2.3
CatalogNumber: AB52298
ChemicalName: Z-DAP-OH
CasNumber: 35761-26-3
MolecularFormula: C11H14N2O4
MolecularWeight: 238.2399
MdlNumber: MFCD00237345
Smiles: NC[C@@H](C(=O)O)NC(=O)OCc1ccccc1
Complexity: 264
Covalently-bondedUnitCount: 1
DefinedAtomStereocenterCount: 1
HeavyAtomCount: 17
HydrogenBondAcceptorCount: 5
HydrogenBondDonorCount: 3
RotatableBondCount: 6
Xlogp3: -2.2
CatalogNumber:
AB52298
ChemicalName:
Z-DAP-OH
CasNumber:
35761-26-3
MolecularFormula:
C11H14N2O4
MolecularWeight:
238.2399
MdlNumber:
MFCD00237345
Smiles:
NC[C@@H](C(=O)O)NC(=O)OCc1ccccc1
Complexity:
264
Covalently-bondedUnitCount:
1
DefinedAtomStereocenterCount:
1
HeavyAtomCount:
17
HydrogenBondAcceptorCount:
5
HydrogenBondDonorCount:
3
RotatableBondCount:
6
Xlogp3:
-2.2
CatalogNumber: AB52299
ChemicalName: 5-Hydroxypentanal
CasNumber: 4221-03-8
MolecularFormula: C5H10O2
MolecularWeight: 102.1317
MdlNumber: MFCD00044411
Smiles: OCCCCC=O
Complexity: 43.3
Covalently-bondedUnitCount: 1
DefinedAtomStereocenterCount: __
HeavyAtomCount: 7
HydrogenBondAcceptorCount: 2
HydrogenBondDonorCount: 1
RotatableBondCount: 4
Xlogp3: -0.3
CatalogNumber:
AB52299
ChemicalName:
5-Hydroxypentanal
CasNumber:
4221-03-8
MolecularFormula:
C5H10O2
MolecularWeight:
102.1317
MdlNumber:
MFCD00044411
Smiles:
OCCCCC=O
Complexity:
43.3
Covalently-bondedUnitCount:
1
DefinedAtomStereocenterCount:
__
HeavyAtomCount:
7
HydrogenBondAcceptorCount:
2
HydrogenBondDonorCount:
1
RotatableBondCount:
4
Xlogp3:
-0.3
CatalogNumber: AB52300
ChemicalName: Lauric acid monoethanolamide
CasNumber: 142-78-9
MolecularFormula: C14H29NO2
MolecularWeight: 243.3856
MdlNumber: MFCD00020561
Smiles: CCCCCCCCCCCC(=O)NCCO
Complexity: 172
Covalently-bondedUnitCount: 1
DefinedAtomStereocenterCount: __
HeavyAtomCount: 17
HydrogenBondAcceptorCount: 2
HydrogenBondDonorCount: 2
RotatableBondCount: 12
Xlogp3: 4
CatalogNumber:
AB52300
ChemicalName:
Lauric acid monoethanolamide
CasNumber:
142-78-9
MolecularFormula:
C14H29NO2
MolecularWeight:
243.3856
MdlNumber:
MFCD00020561
Smiles:
CCCCCCCCCCCC(=O)NCCO
Complexity:
172
Covalently-bondedUnitCount:
1
DefinedAtomStereocenterCount:
__
HeavyAtomCount:
17
HydrogenBondAcceptorCount:
2
HydrogenBondDonorCount:
2
RotatableBondCount:
12
Xlogp3:
4