AG66241
60772-67-0 | 3-Isopropoxybenzoic acid
Manufacturer: A2B Chem
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CatalogNumber
AG66241
ChemicalName
3-Isopropoxybenzoic acid
CasNumber
60772-67-0
MolecularFormula
C10H12O3
MolecularWeight
180.2005
MdlNumber
MFCD01922170
Smiles
CC(Oc1cccc(c1)C(=O)O)C
Complexity
177
Covalently-bondedUnitCount
1
HeavyAtomCount
13
HydrogenBondAcceptorCount
3
HydrogenBondDonorCount
1
RotatableBondCount
3
Xlogp3
2.8
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CatalogNumber: AG66241
ChemicalName: 3-Isopropoxybenzoic acid
CasNumber: 60772-67-0
MolecularFormula: C10H12O3
MolecularWeight: 180.2005
MdlNumber: MFCD01922170
Smiles: CC(Oc1cccc(c1)C(=O)O)C
Complexity: 177
Covalently-bondedUnitCount: 1
HeavyAtomCount: 13
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: 1
RotatableBondCount: 3
Xlogp3: 2.8
CatalogNumber:
AG66241
ChemicalName:
3-Isopropoxybenzoic acid
CasNumber:
60772-67-0
MolecularFormula:
C10H12O3
MolecularWeight:
180.2005
MdlNumber:
MFCD01922170
Smiles:
CC(Oc1cccc(c1)C(=O)O)C
Complexity:
177
Covalently-bondedUnitCount:
1
HeavyAtomCount:
13
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
1
RotatableBondCount:
3
Xlogp3:
2.8
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
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Smiles: COC1=C(C=C(C=C1)Br)C(=O)Cl
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
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MolecularFormula:
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Smiles:
COC1=C(C=C(C=C1)Br)C(=O)Cl
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
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HydrogenBondDonorCount:
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RotatableBondCount:
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Xlogp3:
__
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ChemicalName: __
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Smiles: Fc1ccc(cc1)c1oc2c(n1)c(Br)c(c(c2)Br)N
Complexity: __
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HeavyAtomCount: __
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MolecularFormula:
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MolecularWeight:
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Smiles:
Fc1ccc(cc1)c1oc2c(n1)c(Br)c(c(c2)Br)N
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
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HydrogenBondDonorCount:
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RotatableBondCount:
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Xlogp3:
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Smiles: Ic1cccc(c1)c1oc2c(n1)c(Br)c(c(c2)Br)N
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
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CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
Ic1cccc(c1)c1oc2c(n1)c(Br)c(c(c2)Br)N
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__