AE62749
1261985-23-2 | 2-Methyl-5-(thiophen-3-yl)phenol
Manufacturer: A2B Chem
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CatalogNumber
AE62749
ChemicalName
2-Methyl-5-(thiophen-3-yl)phenol
CasNumber
1261985-23-2
MolecularFormula
C11H10OS
MolecularWeight
190.2615
MdlNumber
MFCD18313076
Smiles
Cc1ccc(cc1O)c1cscc1
Complexity
172
Covalently-bondedUnitCount
1
HeavyAtomCount
13
HydrogenBondAcceptorCount
2
HydrogenBondDonorCount
1
RotatableBondCount
1
Xlogp3
3.2
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CatalogNumber: AE62749
ChemicalName: 2-Methyl-5-(thiophen-3-yl)phenol
CasNumber: 1261985-23-2
MolecularFormula: C11H10OS
MolecularWeight: 190.2615
MdlNumber: MFCD18313076
Smiles: Cc1ccc(cc1O)c1cscc1
Complexity: 172
Covalently-bondedUnitCount: 1
HeavyAtomCount: 13
HydrogenBondAcceptorCount: 2
HydrogenBondDonorCount: 1
RotatableBondCount: 1
Xlogp3: 3.2
CatalogNumber:
AE62749
ChemicalName:
2-Methyl-5-(thiophen-3-yl)phenol
CasNumber:
1261985-23-2
MolecularFormula:
C11H10OS
MolecularWeight:
190.2615
MdlNumber:
MFCD18313076
Smiles:
Cc1ccc(cc1O)c1cscc1
Complexity:
172
Covalently-bondedUnitCount:
1
HeavyAtomCount:
13
HydrogenBondAcceptorCount:
2
HydrogenBondDonorCount:
1
RotatableBondCount:
1
Xlogp3:
3.2
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: COC(=O)c1cc(N)c(c(c1)Br)F
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
COC(=O)c1cc(N)c(c(c1)Br)F
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: COC(=O)c1ccc(c(c1)NC1CC1)N
Complexity: 241
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: 1.6
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
COC(=O)c1ccc(c(c1)NC1CC1)N
Complexity:
241
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
1.6
CatalogNumber: AE62752
ChemicalName: Methyl 2-amino-3,5-dibromo-4-fluorobenzoate
CasNumber: 1403483-78-2
MolecularFormula: C8H6Br2FNO2
MolecularWeight: 326.9451
MdlNumber: MFCD22549335
Smiles: COC(=O)c1cc(Br)c(c(c1N)Br)F
Complexity: 229
Covalently-bondedUnitCount: 1
HeavyAtomCount: 14
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: 1
RotatableBondCount: 2
Xlogp3: 3.1
CatalogNumber:
AE62752
ChemicalName:
Methyl 2-amino-3,5-dibromo-4-fluorobenzoate
CasNumber:
1403483-78-2
MolecularFormula:
C8H6Br2FNO2
MolecularWeight:
326.9451
MdlNumber:
MFCD22549335
Smiles:
COC(=O)c1cc(Br)c(c(c1N)Br)F
Complexity:
229
Covalently-bondedUnitCount:
1
HeavyAtomCount:
14
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
1
RotatableBondCount:
2
Xlogp3:
3.1