AE18290
106428-04-0 | Methyl 3-fluoro-2-methoxybenzoate
Manufacturer: A2B Chem
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CatalogNumber
AE18290
ChemicalName
Methyl 3-fluoro-2-methoxybenzoate
CasNumber
106428-04-0
MolecularFormula
C9H9FO3
MolecularWeight
184.1644
MdlNumber
MFCD09753133
Smiles
COC(=O)c1cccc(c1OC)F
Complexity
184
Covalently-bondedUnitCount
1
HeavyAtomCount
13
HydrogenBondAcceptorCount
4
RotatableBondCount
3
Xlogp3
2.1
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CatalogNumber: AE18290
ChemicalName: Methyl 3-fluoro-2-methoxybenzoate
CasNumber: 106428-04-0
MolecularFormula: C9H9FO3
MolecularWeight: 184.1644
MdlNumber: MFCD09753133
Smiles: COC(=O)c1cccc(c1OC)F
Complexity: 184
Covalently-bondedUnitCount: 1
HeavyAtomCount: 13
HydrogenBondAcceptorCount: 4
RotatableBondCount: 3
Xlogp3: 2.1
CatalogNumber:
AE18290
ChemicalName:
Methyl 3-fluoro-2-methoxybenzoate
CasNumber:
106428-04-0
MolecularFormula:
C9H9FO3
MolecularWeight:
184.1644
MdlNumber:
MFCD09753133
Smiles:
COC(=O)c1cccc(c1OC)F
Complexity:
184
Covalently-bondedUnitCount:
1
HeavyAtomCount:
13
HydrogenBondAcceptorCount:
4
RotatableBondCount:
3
Xlogp3:
2.1
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: CCCCCCCCC=CCCCCCCCC(=O)OC[C@@H](OC(=O)CCCCCCCC=CCCCCCCCC)COP(=O)(OCCNC(=O)CCCC(=O)O)[O-].[Na+]
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
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MolecularFormula:
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MolecularWeight:
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Smiles:
CCCCCCCCC=CCCCCCCCC(=O)OC[C@@H](OC(=O)CCCCCCCC=CCCCCCCCC)COP(=O)(OCCNC(=O)CCCC(=O)O)[O-].[Na+]
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__
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ChemicalName: __
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MolecularFormula: __
MolecularWeight: __
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Smiles: NCCNC(=O)CCCC[C@@H]1SC[C@H]2[C@@H]1NC(=O)N2.Cl
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
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MolecularFormula:
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MolecularWeight:
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Smiles:
NCCNC(=O)CCCC[C@@H]1SC[C@H]2[C@@H]1NC(=O)N2.Cl
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__
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MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: [O-]C(=O)C(F)(F)F.[O-]C(=O)C(F)(F)F.[N+]CCNCCNC(=O)c1ccccc1c1c2-c(cc(=NCC)c(c2)C)oc2c1cc(C)c(c2)[NH2+]CC
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
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CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
[O-]C(=O)C(F)(F)F.[O-]C(=O)C(F)(F)F.[N+]CCNCCNC(=O)c1ccccc1c1c2-c(cc(=NCC)c(c2)C)oc2c1cc(C)c(c2)[NH2+]CC
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__