AB44595
99-06-9 | 3-Hydroxybenzoic acid
Manufacturer: A2B Chem
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CatalogNumber
AB44595
ChemicalName
3-Hydroxybenzoic acid
CasNumber
99-06-9
MolecularFormula
C7H6O3
MolecularWeight
138.1207
MdlNumber
MFCD00002506
Smiles
Oc1cccc(c1)C(=O)O
NscNumber
55746
Complexity
133
Covalently-bondedUnitCount
1
HeavyAtomCount
10
HydrogenBondAcceptorCount
3
HydrogenBondDonorCount
2
RotatableBondCount
1
Xlogp3
1.5
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CatalogNumber: AB44595
ChemicalName: 3-Hydroxybenzoic acid
CasNumber: 99-06-9
MolecularFormula: C7H6O3
MolecularWeight: 138.1207
MdlNumber: MFCD00002506
Smiles: Oc1cccc(c1)C(=O)O
NscNumber: 55746
Complexity: 133
Covalently-bondedUnitCount: 1
HeavyAtomCount: 10
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: 2
RotatableBondCount: 1
Xlogp3: 1.5
CatalogNumber:
AB44595
ChemicalName:
3-Hydroxybenzoic acid
CasNumber:
99-06-9
MolecularFormula:
C7H6O3
MolecularWeight:
138.1207
MdlNumber:
MFCD00002506
Smiles:
Oc1cccc(c1)C(=O)O
NscNumber:
55746
Complexity:
133
Covalently-bondedUnitCount:
1
HeavyAtomCount:
10
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
2
RotatableBondCount:
1
Xlogp3:
1.5
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: Oc1ncc2c(c1)cccc2
NscNumber: __
Complexity: 319
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: 0.6
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
Oc1ncc2c(c1)cccc2
NscNumber:
__
Complexity:
319
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
0.6
CatalogNumber: AB44597
ChemicalName: Alpha-[2-(methylamino)ethyl]benzyl alcohol
CasNumber: 42142-52-9
MolecularFormula: C10H15NO
MolecularWeight: 165.2322
MdlNumber: MFCD00674078
Smiles: CNCCC(c1ccccc1)O
NscNumber: __
Complexity: 110
Covalently-bondedUnitCount: 1
HeavyAtomCount: 12
HydrogenBondAcceptorCount: 2
HydrogenBondDonorCount: 2
RotatableBondCount: 4
Xlogp3: 1
CatalogNumber:
AB44597
ChemicalName:
Alpha-[2-(methylamino)ethyl]benzyl alcohol
CasNumber:
42142-52-9
MolecularFormula:
C10H15NO
MolecularWeight:
165.2322
MdlNumber:
MFCD00674078
Smiles:
CNCCC(c1ccccc1)O
NscNumber:
__
Complexity:
110
Covalently-bondedUnitCount:
1
HeavyAtomCount:
12
HydrogenBondAcceptorCount:
2
HydrogenBondDonorCount:
2
RotatableBondCount:
4
Xlogp3:
1
CatalogNumber: AB44598
ChemicalName: 3-Hydroxy-2-methylbenzoic acid
CasNumber: 603-80-5
MolecularFormula: C8H8O3
MolecularWeight: 152.1473
MdlNumber: MFCD01319973
Smiles: OC(=O)c1cccc(c1C)O
NscNumber: 73133
Complexity: 155
Covalently-bondedUnitCount: 1
HeavyAtomCount: 11
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: 2
RotatableBondCount: 1
Xlogp3: 1.5
CatalogNumber:
AB44598
ChemicalName:
3-Hydroxy-2-methylbenzoic acid
CasNumber:
603-80-5
MolecularFormula:
C8H8O3
MolecularWeight:
152.1473
MdlNumber:
MFCD01319973
Smiles:
OC(=O)c1cccc(c1C)O
NscNumber:
73133
Complexity:
155
Covalently-bondedUnitCount:
1
HeavyAtomCount:
11
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
2
RotatableBondCount:
1
Xlogp3:
1.5