AB67619
4919-37-3 | 4-Hydroxy-3,5-dimethylbenzoic acid
Manufacturer: A2B Chem
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CatalogNumber
AB67619
ChemicalName
4-Hydroxy-3,5-dimethylbenzoic acid
CasNumber
4919-37-3
MolecularFormula
C9H10O3
MolecularWeight
166.1739
MdlNumber
MFCD00016536
Smiles
OC(=O)c1cc(C)c(c(c1)C)O
NscNumber
68319
Complexity
167
Covalently-bondedUnitCount
1
HeavyAtomCount
12
HydrogenBondAcceptorCount
3
HydrogenBondDonorCount
2
RotatableBondCount
1
Xlogp3
0.9
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CatalogNumber: AB67619
ChemicalName: 4-Hydroxy-3,5-dimethylbenzoic acid
CasNumber: 4919-37-3
MolecularFormula: C9H10O3
MolecularWeight: 166.1739
MdlNumber: MFCD00016536
Smiles: OC(=O)c1cc(C)c(c(c1)C)O
NscNumber: 68319
Complexity: 167
Covalently-bondedUnitCount: 1
HeavyAtomCount: 12
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: 2
RotatableBondCount: 1
Xlogp3: 0.9
CatalogNumber:
AB67619
ChemicalName:
4-Hydroxy-3,5-dimethylbenzoic acid
CasNumber:
4919-37-3
MolecularFormula:
C9H10O3
MolecularWeight:
166.1739
MdlNumber:
MFCD00016536
Smiles:
OC(=O)c1cc(C)c(c(c1)C)O
NscNumber:
68319
Complexity:
167
Covalently-bondedUnitCount:
1
HeavyAtomCount:
12
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
2
RotatableBondCount:
1
Xlogp3:
0.9
CatalogNumber: AB67620
ChemicalName: 4-Hydroxy-3,5-dimethylphenylboronic acid
CasNumber: 934826-20-7
MolecularFormula: C8H11BO3
MolecularWeight: 165.9821
MdlNumber: MFCD13181647
Smiles: OB(c1cc(C)c(c(c1)C)O)O
NscNumber: __
Complexity: 139
Covalently-bondedUnitCount: 1
HeavyAtomCount: 12
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: 3
RotatableBondCount: 1
Xlogp3: __
CatalogNumber:
AB67620
ChemicalName:
4-Hydroxy-3,5-dimethylphenylboronic acid
CasNumber:
934826-20-7
MolecularFormula:
C8H11BO3
MolecularWeight:
165.9821
MdlNumber:
MFCD13181647
Smiles:
OB(c1cc(C)c(c(c1)C)O)O
NscNumber:
__
Complexity:
139
Covalently-bondedUnitCount:
1
HeavyAtomCount:
12
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
3
RotatableBondCount:
1
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: Cc1cc(O)c(c(=O)o1)C
NscNumber: __
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
Cc1cc(O)c(c(=O)o1)C
NscNumber:
__
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: AB67622
ChemicalName: 4-Hydroxy-3-iodobenzoic acid
CasNumber: 37470-46-5
MolecularFormula: C7H5IO3
MolecularWeight: 264.0173
MdlNumber: MFCD00234263
Smiles: OC(=O)c1ccc(c(c1)I)O
NscNumber: __
Complexity: 160
Covalently-bondedUnitCount: 1
HeavyAtomCount: 11
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: 2
RotatableBondCount: 1
Xlogp3: 1.7
CatalogNumber:
AB67622
ChemicalName:
4-Hydroxy-3-iodobenzoic acid
CasNumber:
37470-46-5
MolecularFormula:
C7H5IO3
MolecularWeight:
264.0173
MdlNumber:
MFCD00234263
Smiles:
OC(=O)c1ccc(c(c1)I)O
NscNumber:
__
Complexity:
160
Covalently-bondedUnitCount:
1
HeavyAtomCount:
11
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
2
RotatableBondCount:
1
Xlogp3:
1.7