AB49268
53339-53-0 | 4-Mercaptobenzyl alcohol
Manufacturer: A2B Chem
The price for this product is unavailable. Please request a quote
CatalogNumber
AB49268
ChemicalName
4-Mercaptobenzyl alcohol
CasNumber
53339-53-0
MolecularFormula
C7H8OS
MolecularWeight
140.2028
MdlNumber
MFCD00041529
Smiles
OCc1ccc(cc1)S
Complexity
77
Covalently-bondedUnitCount
1
HeavyAtomCount
9
HydrogenBondAcceptorCount
2
HydrogenBondDonorCount
2
RotatableBondCount
1
Xlogp3
1.5
Compare Similar Items
Show Difference
CatalogNumber: AB49268
ChemicalName: 4-Mercaptobenzyl alcohol
CasNumber: 53339-53-0
MolecularFormula: C7H8OS
MolecularWeight: 140.2028
MdlNumber: MFCD00041529
Smiles: OCc1ccc(cc1)S
Complexity: 77
Covalently-bondedUnitCount: 1
HeavyAtomCount: 9
HydrogenBondAcceptorCount: 2
HydrogenBondDonorCount: 2
RotatableBondCount: 1
Xlogp3: 1.5
CatalogNumber:
AB49268
ChemicalName:
4-Mercaptobenzyl alcohol
CasNumber:
53339-53-0
MolecularFormula:
C7H8OS
MolecularWeight:
140.2028
MdlNumber:
MFCD00041529
Smiles:
OCc1ccc(cc1)S
Complexity:
77
Covalently-bondedUnitCount:
1
HeavyAtomCount:
9
HydrogenBondAcceptorCount:
2
HydrogenBondDonorCount:
2
RotatableBondCount:
1
Xlogp3:
1.5
CatalogNumber: AB49269
ChemicalName: 5-Chloropyrazine-2-carbonitrile
CasNumber: 36070-75-4
MolecularFormula: C5H2ClN3
MolecularWeight: 139.5425
MdlNumber: MFCD09607700
Smiles: Clc1cnc(cn1)C#N
Complexity: 138
Covalently-bondedUnitCount: 1
HeavyAtomCount: 9
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: 0.9
CatalogNumber:
AB49269
ChemicalName:
5-Chloropyrazine-2-carbonitrile
CasNumber:
36070-75-4
MolecularFormula:
C5H2ClN3
MolecularWeight:
139.5425
MdlNumber:
MFCD09607700
Smiles:
Clc1cnc(cn1)C#N
Complexity:
138
Covalently-bondedUnitCount:
1
HeavyAtomCount:
9
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
0.9
CatalogNumber: AB49270
ChemicalName: 4-Hydroxyquinoline-3-carboxylic acid
CasNumber: 34785-11-0
MolecularFormula: C10H7NO3
MolecularWeight: 189.1675
MdlNumber: MFCD00598887
Smiles: OC(=O)c1cnc2c(c1O)cccc2
Complexity: 309
Covalently-bondedUnitCount: 1
HeavyAtomCount: 14
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: 2
RotatableBondCount: 1
Xlogp3: 1.8
CatalogNumber:
AB49270
ChemicalName:
4-Hydroxyquinoline-3-carboxylic acid
CasNumber:
34785-11-0
MolecularFormula:
C10H7NO3
MolecularWeight:
189.1675
MdlNumber:
MFCD00598887
Smiles:
OC(=O)c1cnc2c(c1O)cccc2
Complexity:
309
Covalently-bondedUnitCount:
1
HeavyAtomCount:
14
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
2
RotatableBondCount:
1
Xlogp3:
1.8
CatalogNumber: AB49271
ChemicalName: 3-Bromoisoquinoline
CasNumber: 34784-02-6
MolecularFormula: C9H6BrN
MolecularWeight: 208.0546
MdlNumber: MFCD00234479
Smiles: Brc1ncc2c(c1)cccc2
Complexity: 138
Covalently-bondedUnitCount: 1
HeavyAtomCount: 11
HydrogenBondAcceptorCount: 1
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: 3.1
CatalogNumber:
AB49271
ChemicalName:
3-Bromoisoquinoline
CasNumber:
34784-02-6
MolecularFormula:
C9H6BrN
MolecularWeight:
208.0546
MdlNumber:
MFCD00234479
Smiles:
Brc1ncc2c(c1)cccc2
Complexity:
138
Covalently-bondedUnitCount:
1
HeavyAtomCount:
11
HydrogenBondAcceptorCount:
1
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
3.1