AB33522
29006-01-7 | Methyl 4-methoxybutanoate
Manufacturer: A2B Chem
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CatalogNumber
AB33522
ChemicalName
Methyl 4-methoxybutanoate
CasNumber
29006-01-7
MolecularFormula
C6H12O3
MolecularWeight
132.1577
MdlNumber
MFCD05865184
Smiles
COCCCC(=O)OC
Complexity
80.4
Covalently-bondedUnitCount
1
HeavyAtomCount
9
HydrogenBondAcceptorCount
3
RotatableBondCount
5
Xlogp3
0.6
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CatalogNumber: AB33522
ChemicalName: Methyl 4-methoxybutanoate
CasNumber: 29006-01-7
MolecularFormula: C6H12O3
MolecularWeight: 132.1577
MdlNumber: MFCD05865184
Smiles: COCCCC(=O)OC
Complexity: 80.4
Covalently-bondedUnitCount: 1
HeavyAtomCount: 9
HydrogenBondAcceptorCount: 3
RotatableBondCount: 5
Xlogp3: 0.6
CatalogNumber:
AB33522
ChemicalName:
Methyl 4-methoxybutanoate
CasNumber:
29006-01-7
MolecularFormula:
C6H12O3
MolecularWeight:
132.1577
MdlNumber:
MFCD05865184
Smiles:
COCCCC(=O)OC
Complexity:
80.4
Covalently-bondedUnitCount:
1
HeavyAtomCount:
9
HydrogenBondAcceptorCount:
3
RotatableBondCount:
5
Xlogp3:
0.6
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: [O-][N+](=O)c1ccc(c(c1)[N+](=O)[O-])n1nc(c(n1)[N+](=O)[O-])C
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
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CasNumber:
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MolecularFormula:
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MolecularWeight:
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MdlNumber:
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Smiles:
[O-][N+](=O)c1ccc(c(c1)[N+](=O)[O-])n1nc(c(n1)[N+](=O)[O-])C
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__
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ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
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Smiles: ClCc1c(CCl)c(C)c(c(c1C)C)C
Complexity: __
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HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
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__
ChemicalName:
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CasNumber:
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MolecularFormula:
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MolecularWeight:
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MdlNumber:
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Smiles:
ClCc1c(CCl)c(C)c(c(c1C)C)C
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
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MolecularFormula: __
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Smiles: COc1cc2oc(=O)cc(c2cc1N)C
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
COc1cc2oc(=O)cc(c2cc1N)C
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__