AA52697
1214332-35-0 | Ethyl 6-amino-3-bromopicolinate
Manufacturer: A2B Chem
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CatalogNumber
AA52697
ChemicalName
Ethyl 6-amino-3-bromopicolinate
CasNumber
1214332-35-0
MolecularFormula
C8H9BrN2O2
MolecularWeight
245.0733
MdlNumber
MFCD13182435
Smiles
CCOC(=O)c1nc(N)ccc1Br
Complexity
189
Covalently-bondedUnitCount
1
HeavyAtomCount
13
HydrogenBondAcceptorCount
4
HydrogenBondDonorCount
1
RotatableBondCount
3
Xlogp3
1.7
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CatalogNumber: AA52697
ChemicalName: Ethyl 6-amino-3-bromopicolinate
CasNumber: 1214332-35-0
MolecularFormula: C8H9BrN2O2
MolecularWeight: 245.0733
MdlNumber: MFCD13182435
Smiles: CCOC(=O)c1nc(N)ccc1Br
Complexity: 189
Covalently-bondedUnitCount: 1
HeavyAtomCount: 13
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: 1
RotatableBondCount: 3
Xlogp3: 1.7
CatalogNumber:
AA52697
ChemicalName:
Ethyl 6-amino-3-bromopicolinate
CasNumber:
1214332-35-0
MolecularFormula:
C8H9BrN2O2
MolecularWeight:
245.0733
MdlNumber:
MFCD13182435
Smiles:
CCOC(=O)c1nc(N)ccc1Br
Complexity:
189
Covalently-bondedUnitCount:
1
HeavyAtomCount:
13
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
1
RotatableBondCount:
3
Xlogp3:
1.7
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: Fc1ccc(cc1)c1ccc(cc1F)C(=O)O
Complexity: 275
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: 3.3
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
Fc1ccc(cc1)c1ccc(cc1F)C(=O)O
Complexity:
275
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
3.3
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: OC(=O)c1[nH]c(=O)ccc1Br
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
OC(=O)c1[nH]c(=O)ccc1Br
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: AA52700
ChemicalName: 2-Fluoro-3-(4-fluorophenyl)benzoic acid
CasNumber: 1214332-32-7
MolecularFormula: C13H8F2O2
MolecularWeight: 234.1982
MdlNumber: MFCD14699217
Smiles: Fc1ccc(cc1)c1cccc(c1F)C(=O)O
Complexity: 275
Covalently-bondedUnitCount: 1
HeavyAtomCount: 17
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: 1
RotatableBondCount: 2
Xlogp3: 3.3
CatalogNumber:
AA52700
ChemicalName:
2-Fluoro-3-(4-fluorophenyl)benzoic acid
CasNumber:
1214332-32-7
MolecularFormula:
C13H8F2O2
MolecularWeight:
234.1982
MdlNumber:
MFCD14699217
Smiles:
Fc1ccc(cc1)c1cccc(c1F)C(=O)O
Complexity:
275
Covalently-bondedUnitCount:
1
HeavyAtomCount:
17
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
1
RotatableBondCount:
2
Xlogp3:
3.3