AB09576
200336-86-3 | Fmoc-asp(2-phenylisopropyl ester)-oh
Manufacturer: A2B Chem
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CatalogNumber
AB09576
ChemicalName
Fmoc-asp(2-phenylisopropyl ester)-oh
CasNumber
200336-86-3
MolecularFormula
C28H27NO6
MolecularWeight
473.5171
MdlNumber
MFCD00237012
Smiles
O=C(N[C@H](C(=O)O)CC(=O)OC(c1ccccc1)(C)C)OCC1c2ccccc2-c2c1cccc2
Complexity
739
Covalently-bondedUnitCount
1
DefinedAtomStereocenterCount
1
HeavyAtomCount
35
HydrogenBondAcceptorCount
6
HydrogenBondDonorCount
2
RotatableBondCount
10
Xlogp3
4.6
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CatalogNumber: AB09576
ChemicalName: Fmoc-asp(2-phenylisopropyl ester)-oh
CasNumber: 200336-86-3
MolecularFormula: C28H27NO6
MolecularWeight: 473.5171
MdlNumber: MFCD00237012
Smiles: O=C(N[C@H](C(=O)O)CC(=O)OC(c1ccccc1)(C)C)OCC1c2ccccc2-c2c1cccc2
Complexity: 739
Covalently-bondedUnitCount: 1
DefinedAtomStereocenterCount: 1
HeavyAtomCount: 35
HydrogenBondAcceptorCount: 6
HydrogenBondDonorCount: 2
RotatableBondCount: 10
Xlogp3: 4.6
CatalogNumber:
AB09576
ChemicalName:
Fmoc-asp(2-phenylisopropyl ester)-oh
CasNumber:
200336-86-3
MolecularFormula:
C28H27NO6
MolecularWeight:
473.5171
MdlNumber:
MFCD00237012
Smiles:
O=C(N[C@H](C(=O)O)CC(=O)OC(c1ccccc1)(C)C)OCC1c2ccccc2-c2c1cccc2
Complexity:
739
Covalently-bondedUnitCount:
1
DefinedAtomStereocenterCount:
1
HeavyAtomCount:
35
HydrogenBondAcceptorCount:
6
HydrogenBondDonorCount:
2
RotatableBondCount:
10
Xlogp3:
4.6
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: O=C(N[C@@H](C(=O)Oc1c(F)c(F)c(c(c1F)F)F)CC(=O)OC(C)(C)C)OCC1c2ccccc2-c2c1cccc2
Complexity: __
Covalently-bondedUnitCount: __
DefinedAtomStereocenterCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
O=C(N[C@@H](C(=O)Oc1c(F)c(F)c(c(c1F)F)F)CC(=O)OC(C)(C)C)OCC1c2ccccc2-c2c1cccc2
Complexity:
__
Covalently-bondedUnitCount:
__
DefinedAtomStereocenterCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: CCOc1cc(Br)cc(c1O)C=O
Complexity: __
Covalently-bondedUnitCount: __
DefinedAtomStereocenterCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
CCOc1cc(Br)cc(c1O)C=O
Complexity:
__
Covalently-bondedUnitCount:
__
DefinedAtomStereocenterCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: AB09581
ChemicalName: Sodium ethanesulfinate
CasNumber: 20035-08-9
MolecularFormula: C2H5NaO2S
MolecularWeight: 116.1147
MdlNumber: MFCD06659476
Smiles: [O-]S(=O)CC.[Na+]
Complexity: 46.8
Covalently-bondedUnitCount: 2
DefinedAtomStereocenterCount: __
HeavyAtomCount: 6
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: __
RotatableBondCount: 1
Xlogp3: __
CatalogNumber:
AB09581
ChemicalName:
Sodium ethanesulfinate
CasNumber:
20035-08-9
MolecularFormula:
C2H5NaO2S
MolecularWeight:
116.1147
MdlNumber:
MFCD06659476
Smiles:
[O-]S(=O)CC.[Na+]
Complexity:
46.8
Covalently-bondedUnitCount:
2
DefinedAtomStereocenterCount:
__
HeavyAtomCount:
6
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
__
RotatableBondCount:
1
Xlogp3:
__