AB77775
38433-95-3 | (9Z,12Z)-Propyl octadeca-9,12-dienoate
Manufacturer: A2B Chem
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CatalogNumber
AB77775
ChemicalName
(9Z,12Z)-Propyl octadeca-9,12-dienoate
CasNumber
38433-95-3
MolecularFormula
C21H38O2
MolecularWeight
322.52522
MdlNumber
MFCD00048894
Smiles
CCCCCC=CCC=CCCCCCCCC(=O)OCCC
Complexity
305
Covalently-bondedUnitCount
1
HeavyAtomCount
23
HydrogenBondAcceptorCount
2
RotatableBondCount
17
UndefinedBondStereocenterCount
2
Xlogp3
7.8
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CatalogNumber: AB77775
ChemicalName: (9Z,12Z)-Propyl octadeca-9,12-dienoate
CasNumber: 38433-95-3
MolecularFormula: C21H38O2
MolecularWeight: 322.52522
MdlNumber: MFCD00048894
Smiles: CCCCCC=CCC=CCCCCCCCC(=O)OCCC
Complexity: 305
Covalently-bondedUnitCount: 1
HeavyAtomCount: 23
HydrogenBondAcceptorCount: 2
RotatableBondCount: 17
UndefinedBondStereocenterCount: 2
Xlogp3: 7.8
CatalogNumber:
AB77775
ChemicalName:
(9Z,12Z)-Propyl octadeca-9,12-dienoate
CasNumber:
38433-95-3
MolecularFormula:
C21H38O2
MolecularWeight:
322.52522
MdlNumber:
MFCD00048894
Smiles:
CCCCCC=CCC=CCCCCCCCC(=O)OCCC
Complexity:
305
Covalently-bondedUnitCount:
1
HeavyAtomCount:
23
HydrogenBondAcceptorCount:
2
RotatableBondCount:
17
UndefinedBondStereocenterCount:
2
Xlogp3:
7.8
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Smiles: CCCOC(=O)C(=C)C
Complexity: __
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HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
UndefinedBondStereocenterCount: __
Xlogp3: __
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Smiles:
CCCOC(=O)C(=C)C
Complexity:
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HydrogenBondAcceptorCount:
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RotatableBondCount:
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UndefinedBondStereocenterCount:
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Smiles: CCCNCCCN
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Smiles:
CCCNCCCN
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HeavyAtomCount:
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HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
UndefinedBondStereocenterCount:
__
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: CCCOC(=O)C(CC)C
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
UndefinedBondStereocenterCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
CCCOC(=O)C(CC)C
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
UndefinedBondStereocenterCount:
__
Xlogp3:
__