AA82114
1599-49-1 | 4-Methyl-2-pentyl-1,3-dioxolane
Manufacturer: A2B Chem
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CatalogNumber
AA82114
ChemicalName
4-Methyl-2-pentyl-1,3-dioxolane
CasNumber
1599-49-1
MolecularFormula
C9H18O2
MolecularWeight
158.238
MdlNumber
MFCD00065423
Smiles
CCCCCC1OCC(O1)C
Complexity
104
Covalently-bondedUnitCount
1
HeavyAtomCount
11
HydrogenBondAcceptorCount
2
RotatableBondCount
4
UndefinedAtomStereocenterCount
2
Xlogp3
2.6
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CatalogNumber: AA82114
ChemicalName: 4-Methyl-2-pentyl-1,3-dioxolane
CasNumber: 1599-49-1
MolecularFormula: C9H18O2
MolecularWeight: 158.238
MdlNumber: MFCD00065423
Smiles: CCCCCC1OCC(O1)C
Complexity: 104
Covalently-bondedUnitCount: 1
HeavyAtomCount: 11
HydrogenBondAcceptorCount: 2
RotatableBondCount: 4
UndefinedAtomStereocenterCount: 2
Xlogp3: 2.6
CatalogNumber:
AA82114
ChemicalName:
4-Methyl-2-pentyl-1,3-dioxolane
CasNumber:
1599-49-1
MolecularFormula:
C9H18O2
MolecularWeight:
158.238
MdlNumber:
MFCD00065423
Smiles:
CCCCCC1OCC(O1)C
Complexity:
104
Covalently-bondedUnitCount:
1
HeavyAtomCount:
11
HydrogenBondAcceptorCount:
2
RotatableBondCount:
4
UndefinedAtomStereocenterCount:
2
Xlogp3:
2.6
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Smiles: CCCCCC(OC)OC
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HydrogenBondAcceptorCount: __
RotatableBondCount: __
UndefinedAtomStereocenterCount: __
Xlogp3: __
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Smiles:
CCCCCC(OC)OC
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Smiles: ClC(C(Cl)(F)F)(C(F)(F)F)Cl
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Smiles:
ClC(C(Cl)(F)F)(C(F)(F)F)Cl
Complexity:
__
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__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
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UndefinedAtomStereocenterCount:
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Smiles: O=C1CS(=O)(=O)C1
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MolecularFormula:
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MolecularWeight:
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MdlNumber:
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Smiles:
O=C1CS(=O)(=O)C1
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
UndefinedAtomStereocenterCount:
__
Xlogp3:
__