AG19786
52570-33-9 | Methyl 3-iodo-2-methylbenzoate
Manufacturer: A2B Chem
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CatalogNumber
AG19786
ChemicalName
Methyl 3-iodo-2-methylbenzoate
CasNumber
52570-33-9
MolecularFormula
C9H9IO2
MolecularWeight
276.071
MdlNumber
MFCD12923250
Smiles
Cc1c(cccc1I)C(=O)OC
Complexity
170
Covalently-bondedUnitCount
1
HeavyAtomCount
12
HydrogenBondAcceptorCount
2
RotatableBondCount
2
Xlogp3
2.8
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CatalogNumber: AG19786
ChemicalName: Methyl 3-iodo-2-methylbenzoate
CasNumber: 52570-33-9
MolecularFormula: C9H9IO2
MolecularWeight: 276.071
MdlNumber: MFCD12923250
Smiles: Cc1c(cccc1I)C(=O)OC
Complexity: 170
Covalently-bondedUnitCount: 1
HeavyAtomCount: 12
HydrogenBondAcceptorCount: 2
RotatableBondCount: 2
Xlogp3: 2.8
CatalogNumber:
AG19786
ChemicalName:
Methyl 3-iodo-2-methylbenzoate
CasNumber:
52570-33-9
MolecularFormula:
C9H9IO2
MolecularWeight:
276.071
MdlNumber:
MFCD12923250
Smiles:
Cc1c(cccc1I)C(=O)OC
Complexity:
170
Covalently-bondedUnitCount:
1
HeavyAtomCount:
12
HydrogenBondAcceptorCount:
2
RotatableBondCount:
2
Xlogp3:
2.8
CatalogNumber: AG19787
ChemicalName: Methyl 6-fluoropicolinate
CasNumber: 455-71-0
MolecularFormula: C7H6FNO2
MolecularWeight: 155.1264
MdlNumber: MFCD11110421
Smiles: COC(=O)c1cccc(n1)F
Complexity: 151
Covalently-bondedUnitCount: 1
HeavyAtomCount: 11
HydrogenBondAcceptorCount: 4
RotatableBondCount: 2
Xlogp3: 1.5
CatalogNumber:
AG19787
ChemicalName:
Methyl 6-fluoropicolinate
CasNumber:
455-71-0
MolecularFormula:
C7H6FNO2
MolecularWeight:
155.1264
MdlNumber:
MFCD11110421
Smiles:
COC(=O)c1cccc(n1)F
Complexity:
151
Covalently-bondedUnitCount:
1
HeavyAtomCount:
11
HydrogenBondAcceptorCount:
4
RotatableBondCount:
2
Xlogp3:
1.5
CatalogNumber: AG19788
ChemicalName: 3-Amino-4-chlorobenzonitrile
CasNumber: 53312-79-1
MolecularFormula: C7H5ClN2
MolecularWeight: 152.581
MdlNumber: MFCD00017089
Smiles: N#Cc1ccc(c(c1)N)Cl
Complexity: 160
Covalently-bondedUnitCount: 1
HeavyAtomCount: 10
HydrogenBondAcceptorCount: 2
RotatableBondCount: __
Xlogp3: 2
CatalogNumber:
AG19788
ChemicalName:
3-Amino-4-chlorobenzonitrile
CasNumber:
53312-79-1
MolecularFormula:
C7H5ClN2
MolecularWeight:
152.581
MdlNumber:
MFCD00017089
Smiles:
N#Cc1ccc(c(c1)N)Cl
Complexity:
160
Covalently-bondedUnitCount:
1
HeavyAtomCount:
10
HydrogenBondAcceptorCount:
2
RotatableBondCount:
__
Xlogp3:
2
CatalogNumber: AG19789
ChemicalName: 7-Bromobenzofuran-2-carboxylic acid
CasNumber: 550998-59-9
MolecularFormula: C9H5BrO3
MolecularWeight: 241.0382
MdlNumber: MFCD10699647
Smiles: OC(=O)c1cc2c(o1)c(Br)ccc2
Complexity: 219
Covalently-bondedUnitCount: 1
HeavyAtomCount: 13
HydrogenBondAcceptorCount: 3
RotatableBondCount: 1
Xlogp3: 3.1
CatalogNumber:
AG19789
ChemicalName:
7-Bromobenzofuran-2-carboxylic acid
CasNumber:
550998-59-9
MolecularFormula:
C9H5BrO3
MolecularWeight:
241.0382
MdlNumber:
MFCD10699647
Smiles:
OC(=O)c1cc2c(o1)c(Br)ccc2
Complexity:
219
Covalently-bondedUnitCount:
1
HeavyAtomCount:
13
HydrogenBondAcceptorCount:
3
RotatableBondCount:
1
Xlogp3:
3.1