AB62082
25415-84-3 | 2-Ethylhexyl butyrate
Manufacturer: A2B Chem
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CatalogNumber
AB62082
ChemicalName
2-Ethylhexyl butyrate
CasNumber
25415-84-3
MolecularFormula
C12H24O2
MolecularWeight
200.3178
MdlNumber
MFCD00059428
Smiles
CCCCC(COC(=O)CCC)CC
Complexity
143
Covalently-bondedUnitCount
1
HeavyAtomCount
14
HydrogenBondAcceptorCount
2
RotatableBondCount
9
UndefinedAtomStereocenterCount
1
Xlogp3
4.1
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CatalogNumber: AB62082
ChemicalName: 2-Ethylhexyl butyrate
CasNumber: 25415-84-3
MolecularFormula: C12H24O2
MolecularWeight: 200.3178
MdlNumber: MFCD00059428
Smiles: CCCCC(COC(=O)CCC)CC
Complexity: 143
Covalently-bondedUnitCount: 1
HeavyAtomCount: 14
HydrogenBondAcceptorCount: 2
RotatableBondCount: 9
UndefinedAtomStereocenterCount: 1
Xlogp3: 4.1
CatalogNumber:
AB62082
ChemicalName:
2-Ethylhexyl butyrate
CasNumber:
25415-84-3
MolecularFormula:
C12H24O2
MolecularWeight:
200.3178
MdlNumber:
MFCD00059428
Smiles:
CCCCC(COC(=O)CCC)CC
Complexity:
143
Covalently-bondedUnitCount:
1
HeavyAtomCount:
14
HydrogenBondAcceptorCount:
2
RotatableBondCount:
9
UndefinedAtomStereocenterCount:
1
Xlogp3:
4.1
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: CCCCC(CON(=O)=O)CC
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
UndefinedAtomStereocenterCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
CCCCC(CON(=O)=O)CC
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
UndefinedAtomStereocenterCount:
__
Xlogp3:
__
CatalogNumber: AB62084
ChemicalName: 2-Ethylhexyl octanoate
CasNumber: 63321-70-0
MolecularFormula: C16H32O2
MolecularWeight: 256.4241
MdlNumber: MFCD12031480
Smiles: CCCCCCCC(=O)OCC(CCCC)CC
Complexity: 190
Covalently-bondedUnitCount: 1
HeavyAtomCount: 18
HydrogenBondAcceptorCount: 2
RotatableBondCount: 13
UndefinedAtomStereocenterCount: 1
Xlogp3: 6.2
CatalogNumber:
AB62084
ChemicalName:
2-Ethylhexyl octanoate
CasNumber:
63321-70-0
MolecularFormula:
C16H32O2
MolecularWeight:
256.4241
MdlNumber:
MFCD12031480
Smiles:
CCCCCCCC(=O)OCC(CCCC)CC
Complexity:
190
Covalently-bondedUnitCount:
1
HeavyAtomCount:
18
HydrogenBondAcceptorCount:
2
RotatableBondCount:
13
UndefinedAtomStereocenterCount:
1
Xlogp3:
6.2
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: CCCCC(COC(=O)c1ccccc1O)CC
Complexity: 240
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
UndefinedAtomStereocenterCount: __
Xlogp3: 5.7
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
CCCCC(COC(=O)c1ccccc1O)CC
Complexity:
240
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
UndefinedAtomStereocenterCount:
__
Xlogp3:
5.7