AB46802
10361-12-3 | 3,4,5-Trihydroxybenzoic acid stearyl ester
Manufacturer: A2B Chem
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CatalogNumber
AB46802
ChemicalName
3,4,5-Trihydroxybenzoic acid stearyl ester
CasNumber
10361-12-3
MolecularFormula
C25H42O5
MolecularWeight
422.598
MdlNumber
MFCD01753118
Smiles
CCCCCCCCCCCCCCCCCCOC(=O)c1cc(O)c(c(c1)O)O
Complexity
402
Covalently-bondedUnitCount
1
HeavyAtomCount
30
HydrogenBondAcceptorCount
5
HydrogenBondDonorCount
3
RotatableBondCount
19
Xlogp3
9.1
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CatalogNumber: AB46802
ChemicalName: 3,4,5-Trihydroxybenzoic acid stearyl ester
CasNumber: 10361-12-3
MolecularFormula: C25H42O5
MolecularWeight: 422.598
MdlNumber: MFCD01753118
Smiles: CCCCCCCCCCCCCCCCCCOC(=O)c1cc(O)c(c(c1)O)O
Complexity: 402
Covalently-bondedUnitCount: 1
HeavyAtomCount: 30
HydrogenBondAcceptorCount: 5
HydrogenBondDonorCount: 3
RotatableBondCount: 19
Xlogp3: 9.1
CatalogNumber:
AB46802
ChemicalName:
3,4,5-Trihydroxybenzoic acid stearyl ester
CasNumber:
10361-12-3
MolecularFormula:
C25H42O5
MolecularWeight:
422.598
MdlNumber:
MFCD01753118
Smiles:
CCCCCCCCCCCCCCCCCCOC(=O)c1cc(O)c(c(c1)O)O
Complexity:
402
Covalently-bondedUnitCount:
1
HeavyAtomCount:
30
HydrogenBondAcceptorCount:
5
HydrogenBondDonorCount:
3
RotatableBondCount:
19
Xlogp3:
9.1
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: OCCOCCOCCOCCOCCOCCOCCOCCO
Complexity: 210
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: -2.2
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
OCCOCCOCCOCCOCCOCCOCCOCCO
Complexity:
210
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
-2.2
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: C[Si]1(C)O[Si](C)(C)O[Si](O[Si](O1)(C)C)(C)C
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
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CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
C[Si]1(C)O[Si](C)(C)O[Si](O[Si](O1)(C)C)(C)C
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: CCCCCCCC(=O)Cl
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
CCCCCCCC(=O)Cl
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__