AE18318
1191064-81-9 | Fmoc-N-amido-PEG9-acid
Manufacturer: A2B Chem
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CatalogNumber
AE18318
ChemicalName
Fmoc-N-amido-PEG9-acid
CasNumber
1191064-81-9
MolecularFormula
C36H53NO13
MolecularWeight
707.8049199999999
MdlNumber
MFCD28385470
Smiles
OC(=O)CCOCCOCCOCCOCCOCCOCCOCCOCCOCCNC(=O)OCC1c2ccccc2-c2c1cccc2
Complexity
831
Covalently-bondedUnitCount
1
HeavyAtomCount
50
HydrogenBondAcceptorCount
13
HydrogenBondDonorCount
2
RotatableBondCount
33
Xlogp3
1.2
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CatalogNumber: AE18318
ChemicalName: Fmoc-N-amido-PEG9-acid
CasNumber: 1191064-81-9
MolecularFormula: C36H53NO13
MolecularWeight: 707.8049199999999
MdlNumber: MFCD28385470
Smiles: OC(=O)CCOCCOCCOCCOCCOCCOCCOCCOCCOCCNC(=O)OCC1c2ccccc2-c2c1cccc2
Complexity: 831
Covalently-bondedUnitCount: 1
HeavyAtomCount: 50
HydrogenBondAcceptorCount: 13
HydrogenBondDonorCount: 2
RotatableBondCount: 33
Xlogp3: 1.2
CatalogNumber:
AE18318
ChemicalName:
Fmoc-N-amido-PEG9-acid
CasNumber:
1191064-81-9
MolecularFormula:
C36H53NO13
MolecularWeight:
707.8049199999999
MdlNumber:
MFCD28385470
Smiles:
OC(=O)CCOCCOCCOCCOCCOCCOCCOCCOCCOCCNC(=O)OCC1c2ccccc2-c2c1cccc2
Complexity:
831
Covalently-bondedUnitCount:
1
HeavyAtomCount:
50
HydrogenBondAcceptorCount:
13
HydrogenBondDonorCount:
2
RotatableBondCount:
33
Xlogp3:
1.2
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: OC[C@H]1O[C@@H](OC2[C@H]3CO[C@@H]2[C@H]([C@H](O3)O[C@@H]2[C@@H](O)[C@H](O)O[C@@H]([C@@H]2OS(=O)(=O)[O-])CO)O)[C@@H]([C@H]([C@H]1O)O[C@H]1O[C@@H]2CO[C@H]([C@H]1O)C2O)O.[Na+]
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
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Smiles:
OC[C@H]1O[C@@H](OC2[C@H]3CO[C@@H]2[C@H]([C@H](O3)O[C@@H]2[C@@H](O)[C@H](O)O[C@@H]([C@@H]2OS(=O)(=O)[O-])CO)O)[C@@H]([C@H]([C@H]1O)O[C@H]1O[C@@H]2CO[C@H]([C@H]1O)C2O)O.[Na+]
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
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Smiles: CCCCCCCCCCCCCCCC(=O)OC[C@@H](OC(=O)O[C@H]1CC[C@]2(C(=CC[C@@H]3[C@@H]2CC[C@]2([C@H]3CC[C@@H]2[C@@H](CCCC(C)C)C)C)C1)C)COP(=O)(OCC[N+](C)(C)C)[O-]
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
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ChemicalName:
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CasNumber:
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MolecularFormula:
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MolecularWeight:
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Smiles:
CCCCCCCCCCCCCCCC(=O)OC[C@@H](OC(=O)O[C@H]1CC[C@]2(C(=CC[C@@H]3[C@@H]2CC[C@]2([C@H]3CC[C@@H]2[C@@H](CCCC(C)C)C)C)C1)C)COP(=O)(OCC[N+](C)(C)C)[O-]
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: CCCCCCCCC=CCCCCCCCC(=O)O[C@@H](COP(=O)(OCC(COP(=O)(OC[C@H](OC(=O)CCCCCCCC=CCCCCCCCC)COC(=O)CCCCCCCC=CCCCCCCC)[O-])O)[O-])COC(=O)CCCCCCCC=CCCCCCCCC.[Na+].[Na+]
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
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ChemicalName:
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CasNumber:
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MolecularFormula:
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MolecularWeight:
__
MdlNumber:
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Smiles:
CCCCCCCCC=CCCCCCCCC(=O)O[C@@H](COP(=O)(OCC(COP(=O)(OC[C@H](OC(=O)CCCCCCCC=CCCCCCCCC)COC(=O)CCCCCCCC=CCCCCCCC)[O-])O)[O-])COC(=O)CCCCCCCC=CCCCCCCCC.[Na+].[Na+]
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__