AG68042
59320-77-3 | 8-Methyl-6-nonenoic acid, predominantly trans
Manufacturer: A2B Chem
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CatalogNumber
AG68042
ChemicalName
8-Methyl-6-nonenoic acid, predominantly trans
CasNumber
59320-77-3
MolecularFormula
C10H18O2
MolecularWeight
170.2487
MdlNumber
MFCD00203855
Smiles
OC(=O)CCCC/C=C/C(C)C
Complexity
148
Covalently-bondedUnitCount
1
DefinedBondStereocenterCount
1
HeavyAtomCount
12
HydrogenBondAcceptorCount
2
HydrogenBondDonorCount
1
RotatableBondCount
6
Xlogp3
2.7
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CatalogNumber: AG68042
ChemicalName: 8-Methyl-6-nonenoic acid, predominantly trans
CasNumber: 59320-77-3
MolecularFormula: C10H18O2
MolecularWeight: 170.2487
MdlNumber: MFCD00203855
Smiles: OC(=O)CCCC/C=C/C(C)C
Complexity: 148
Covalently-bondedUnitCount: 1
DefinedBondStereocenterCount: 1
HeavyAtomCount: 12
HydrogenBondAcceptorCount: 2
HydrogenBondDonorCount: 1
RotatableBondCount: 6
Xlogp3: 2.7
CatalogNumber:
AG68042
ChemicalName:
8-Methyl-6-nonenoic acid, predominantly trans
CasNumber:
59320-77-3
MolecularFormula:
C10H18O2
MolecularWeight:
170.2487
MdlNumber:
MFCD00203855
Smiles:
OC(=O)CCCC/C=C/C(C)C
Complexity:
148
Covalently-bondedUnitCount:
1
DefinedBondStereocenterCount:
1
HeavyAtomCount:
12
HydrogenBondAcceptorCount:
2
HydrogenBondDonorCount:
1
RotatableBondCount:
6
Xlogp3:
2.7
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
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Smiles: C1CCC(CC1)N1CCN(CC1)[C@@H](c1ccccc1)Cc1ccccc1.Cl.Cl
Complexity: __
Covalently-bondedUnitCount: __
DefinedBondStereocenterCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
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CasNumber:
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MolecularFormula:
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Smiles:
C1CCC(CC1)N1CCN(CC1)[C@@H](c1ccccc1)Cc1ccccc1.Cl.Cl
Complexity:
__
Covalently-bondedUnitCount:
__
DefinedBondStereocenterCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
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HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
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ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
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Smiles: O[C@H]1C[C@H](O)C(=C)C(=CC=C2CCC[C@]3([C@H]2CC[C@@H]3[C@@H](CC[C@H](C(C)C)O)C)C)C1
Complexity: __
Covalently-bondedUnitCount: __
DefinedBondStereocenterCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
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CasNumber:
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MolecularFormula:
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MolecularWeight:
__
MdlNumber:
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Smiles:
O[C@H]1C[C@H](O)C(=C)C(=CC=C2CCC[C@]3([C@H]2CC[C@@H]3[C@@H](CC[C@H](C(C)C)O)C)C)C1
Complexity:
__
Covalently-bondedUnitCount:
__
DefinedBondStereocenterCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: CCCCCCCCCCCC(=O)OC[C@@H](OC(=O)CCCCCCCCCCC)CO
Complexity: __
Covalently-bondedUnitCount: __
DefinedBondStereocenterCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
CCCCCCCCCCCC(=O)OC[C@@H](OC(=O)CCCCCCCCCCC)CO
Complexity:
__
Covalently-bondedUnitCount:
__
DefinedBondStereocenterCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__