AB79816
53398-83-7 | Trans-2-hexenyl butyrate
Manufacturer: A2B Chem
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CatalogNumber
AB79816
ChemicalName
Trans-2-hexenyl butyrate
CasNumber
53398-83-7
MolecularFormula
C10H18O2
MolecularWeight
170.2487
MdlNumber
MFCD00036546
Smiles
CCC/C=C/COC(=O)CCC
Complexity
139
Covalently-bondedUnitCount
1
DefinedBondStereocenterCount
1
HeavyAtomCount
12
HydrogenBondAcceptorCount
2
RotatableBondCount
7
Xlogp3
2.8
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CatalogNumber: AB79816
ChemicalName: Trans-2-hexenyl butyrate
CasNumber: 53398-83-7
MolecularFormula: C10H18O2
MolecularWeight: 170.2487
MdlNumber: MFCD00036546
Smiles: CCC/C=C/COC(=O)CCC
Complexity: 139
Covalently-bondedUnitCount: 1
DefinedBondStereocenterCount: 1
HeavyAtomCount: 12
HydrogenBondAcceptorCount: 2
RotatableBondCount: 7
Xlogp3: 2.8
CatalogNumber:
AB79816
ChemicalName:
Trans-2-hexenyl butyrate
CasNumber:
53398-83-7
MolecularFormula:
C10H18O2
MolecularWeight:
170.2487
MdlNumber:
MFCD00036546
Smiles:
CCC/C=C/COC(=O)CCC
Complexity:
139
Covalently-bondedUnitCount:
1
DefinedBondStereocenterCount:
1
HeavyAtomCount:
12
HydrogenBondAcceptorCount:
2
RotatableBondCount:
7
Xlogp3:
2.8
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: CCCCCC(=O)OC/C=C/CCC
Complexity: __
Covalently-bondedUnitCount: __
DefinedBondStereocenterCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
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Smiles:
CCCCCC(=O)OC/C=C/CCC
Complexity:
__
Covalently-bondedUnitCount:
__
DefinedBondStereocenterCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: CCC/C=C/COC(=O)CC(C)C
Complexity: __
Covalently-bondedUnitCount: __
DefinedBondStereocenterCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
CCC/C=C/COC(=O)CC(C)C
Complexity:
__
Covalently-bondedUnitCount:
__
DefinedBondStereocenterCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: [O-][N+](=O)/C=C/c1ccccc1O
Complexity: __
Covalently-bondedUnitCount: __
DefinedBondStereocenterCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
[O-][N+](=O)/C=C/c1ccccc1O
Complexity:
__
Covalently-bondedUnitCount:
__
DefinedBondStereocenterCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__