AI37747
159783-28-5 | 3-(Cyclopropylmethoxy)-4-methoxybenzoic acid
Manufacturer: A2B Chem
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CatalogNumber
AI37747
ChemicalName
3-(Cyclopropylmethoxy)-4-methoxybenzoic acid
CasNumber
159783-28-5
MolecularFormula
C12H14O4
MolecularWeight
222.23716
MdlNumber
MFCD12138842
Smiles
COc1ccc(cc1OCC1CC1)C(=O)O
Complexity
249
Covalently-bondedUnitCount
1
HeavyAtomCount
16
HydrogenBondAcceptorCount
4
HydrogenBondDonorCount
1
RotatableBondCount
5
Xlogp3
2.4
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CatalogNumber: AI37747
ChemicalName: 3-(Cyclopropylmethoxy)-4-methoxybenzoic acid
CasNumber: 159783-28-5
MolecularFormula: C12H14O4
MolecularWeight: 222.23716
MdlNumber: MFCD12138842
Smiles: COc1ccc(cc1OCC1CC1)C(=O)O
Complexity: 249
Covalently-bondedUnitCount: 1
HeavyAtomCount: 16
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: 1
RotatableBondCount: 5
Xlogp3: 2.4
CatalogNumber:
AI37747
ChemicalName:
3-(Cyclopropylmethoxy)-4-methoxybenzoic acid
CasNumber:
159783-28-5
MolecularFormula:
C12H14O4
MolecularWeight:
222.23716
MdlNumber:
MFCD12138842
Smiles:
COc1ccc(cc1OCC1CC1)C(=O)O
Complexity:
249
Covalently-bondedUnitCount:
1
HeavyAtomCount:
16
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
1
RotatableBondCount:
5
Xlogp3:
2.4
CatalogNumber: __
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Smiles: BrCc1c(Cl)cncc1Cl
Complexity: __
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HeavyAtomCount: __
HydrogenBondAcceptorCount: __
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RotatableBondCount: __
Xlogp3: __
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Smiles:
BrCc1c(Cl)cncc1Cl
Complexity:
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HydrogenBondDonorCount:
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RotatableBondCount:
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Smiles: Fc1cccc(c1)C(=O)C1CNC1
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Smiles:
Fc1cccc(c1)C(=O)C1CNC1
Complexity:
__
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__
HydrogenBondAcceptorCount:
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HydrogenBondDonorCount:
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RotatableBondCount:
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Smiles: C1COC(CN1)C2=CC(=CC=C2)C(F)(F)F
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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:
C1COC(CN1)C2=CC(=CC=C2)C(F)(F)F
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
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