AA52574
13335-71-2 | 2,6-Dimethylphenoxyacetic acid
Manufacturer: A2B Chem
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CatalogNumber
AA52574
ChemicalName
2,6-Dimethylphenoxyacetic acid
CasNumber
13335-71-2
MolecularFormula
C10H12O3
MolecularWeight
180.20048
MdlNumber
MFCD00156912
Smiles
OC(=O)COc1c(C)cccc1C
NscNumber
408599
Complexity
169
Covalently-bondedUnitCount
1
HeavyAtomCount
13
HydrogenBondAcceptorCount
3
HydrogenBondDonorCount
1
RotatableBondCount
3
Xlogp3
2.6
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CatalogNumber: AA52574
ChemicalName: 2,6-Dimethylphenoxyacetic acid
CasNumber: 13335-71-2
MolecularFormula: C10H12O3
MolecularWeight: 180.20048
MdlNumber: MFCD00156912
Smiles: OC(=O)COc1c(C)cccc1C
NscNumber: 408599
Complexity: 169
Covalently-bondedUnitCount: 1
HeavyAtomCount: 13
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: 1
RotatableBondCount: 3
Xlogp3: 2.6
CatalogNumber:
AA52574
ChemicalName:
2,6-Dimethylphenoxyacetic acid
CasNumber:
13335-71-2
MolecularFormula:
C10H12O3
MolecularWeight:
180.20048
MdlNumber:
MFCD00156912
Smiles:
OC(=O)COc1c(C)cccc1C
NscNumber:
408599
Complexity:
169
Covalently-bondedUnitCount:
1
HeavyAtomCount:
13
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
1
RotatableBondCount:
3
Xlogp3:
2.6
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Smiles: OCCc1cccc(c1OC)OC
NscNumber: __
Complexity: __
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HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
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Smiles:
OCCc1cccc(c1OC)OC
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Complexity:
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HydrogenBondAcceptorCount:
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RotatableBondCount:
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ChemicalName: __
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MolecularFormula: __
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Smiles: COc1c(C)cc(cc1Cl)Cl
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Complexity: __
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HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
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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:
COc1c(C)cc(cc1Cl)Cl
NscNumber:
__
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
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RotatableBondCount:
__
Xlogp3:
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ChemicalName: __
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Smiles: OC(=O)c1nnn(c1)C1CCCCC1
NscNumber: __
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
OC(=O)c1nnn(c1)C1CCCCC1
NscNumber:
__
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__