AG79829
637347-90-1 | 2-Amino-4-fluoro-5-methoxybenzoic acid
Manufacturer: A2B Chem
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CatalogNumber
AG79829
ChemicalName
2-Amino-4-fluoro-5-methoxybenzoic acid
CasNumber
637347-90-1
MolecularFormula
C8H8FNO3
MolecularWeight
185.1524232
MdlNumber
MFCD16159157
Smiles
COc1cc(C(=O)O)c(cc1F)N
Complexity
200
Covalently-bondedUnitCount
1
HeavyAtomCount
13
HydrogenBondAcceptorCount
5
HydrogenBondDonorCount
2
RotatableBondCount
2
Xlogp3
1.4
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CatalogNumber: AG79829
ChemicalName: 2-Amino-4-fluoro-5-methoxybenzoic acid
CasNumber: 637347-90-1
MolecularFormula: C8H8FNO3
MolecularWeight: 185.1524232
MdlNumber: MFCD16159157
Smiles: COc1cc(C(=O)O)c(cc1F)N
Complexity: 200
Covalently-bondedUnitCount: 1
HeavyAtomCount: 13
HydrogenBondAcceptorCount: 5
HydrogenBondDonorCount: 2
RotatableBondCount: 2
Xlogp3: 1.4
CatalogNumber:
AG79829
ChemicalName:
2-Amino-4-fluoro-5-methoxybenzoic acid
CasNumber:
637347-90-1
MolecularFormula:
C8H8FNO3
MolecularWeight:
185.1524232
MdlNumber:
MFCD16159157
Smiles:
COc1cc(C(=O)O)c(cc1F)N
Complexity:
200
Covalently-bondedUnitCount:
1
HeavyAtomCount:
13
HydrogenBondAcceptorCount:
5
HydrogenBondDonorCount:
2
RotatableBondCount:
2
Xlogp3:
1.4
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: CC(C(=O)N1CCCC1)NC(=O)OCc1ccccc1
Complexity: 334
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: 1.9
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
CC(C(=O)N1CCCC1)NC(=O)OCc1ccccc1
Complexity:
334
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
1.9
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: CC(C(=O)N1CCOCC1)NC(=O)OCc1ccccc1
Complexity: 350
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: 1
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
CC(C(=O)N1CCOCC1)NC(=O)OCc1ccccc1
Complexity:
350
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
1
CatalogNumber: AG79833
ChemicalName: 2,5-Dimethyl-1-[3-(trifluoromethyl)phenyl]pyrrole
CasNumber: 570-04-7
MolecularFormula: C13H12F3N
MolecularWeight: 239.2363
MdlNumber: MFCD03228549
Smiles: Cc1ccc(n1c1cccc(c1)C(F)(F)F)C
Complexity: 254
Covalently-bondedUnitCount: 1
HeavyAtomCount: 17
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: __
RotatableBondCount: 1
Xlogp3: 4
CatalogNumber:
AG79833
ChemicalName:
2,5-Dimethyl-1-[3-(trifluoromethyl)phenyl]pyrrole
CasNumber:
570-04-7
MolecularFormula:
C13H12F3N
MolecularWeight:
239.2363
MdlNumber:
MFCD03228549
Smiles:
Cc1ccc(n1c1cccc(c1)C(F)(F)F)C
Complexity:
254
Covalently-bondedUnitCount:
1
HeavyAtomCount:
17
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
__
RotatableBondCount:
1
Xlogp3:
4