AB48579
90417-53-1 | 5-Methoxy-1h-indazole-3-carboxylic acid
Manufacturer: A2B Chem
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CatalogNumber
AB48579
ChemicalName
5-Methoxy-1h-indazole-3-carboxylic acid
CasNumber
90417-53-1
MolecularFormula
C9H8N2O3
MolecularWeight
192.1714
MdlNumber
MFCD03840712
Smiles
COc1ccc2c(c1)c(n[nH]2)C(=O)O
Complexity
234
Covalently-bondedUnitCount
1
HeavyAtomCount
14
HydrogenBondAcceptorCount
4
HydrogenBondDonorCount
2
RotatableBondCount
2
Xlogp3
1.4
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CatalogNumber: AB48579
ChemicalName: 5-Methoxy-1h-indazole-3-carboxylic acid
CasNumber: 90417-53-1
MolecularFormula: C9H8N2O3
MolecularWeight: 192.1714
MdlNumber: MFCD03840712
Smiles: COc1ccc2c(c1)c(n[nH]2)C(=O)O
Complexity: 234
Covalently-bondedUnitCount: 1
HeavyAtomCount: 14
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: 2
RotatableBondCount: 2
Xlogp3: 1.4
CatalogNumber:
AB48579
ChemicalName:
5-Methoxy-1h-indazole-3-carboxylic acid
CasNumber:
90417-53-1
MolecularFormula:
C9H8N2O3
MolecularWeight:
192.1714
MdlNumber:
MFCD03840712
Smiles:
COc1ccc2c(c1)c(n[nH]2)C(=O)O
Complexity:
234
Covalently-bondedUnitCount:
1
HeavyAtomCount:
14
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
2
RotatableBondCount:
2
Xlogp3:
1.4
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: C=CCOCC(C(F)F)(F)F
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
C=CCOCC(C(F)F)(F)F
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: AB48581
ChemicalName: Methyl 5-amino-2-bromobenzoate
CasNumber: 6942-37-6
MolecularFormula: C8H8BrNO2
MolecularWeight: 230.0586
MdlNumber: MFCD00085568
Smiles: COC(=O)c1cc(N)ccc1Br
Complexity: 174
Covalently-bondedUnitCount: 1
HeavyAtomCount: 12
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: 1
RotatableBondCount: 2
Xlogp3: 2.8
CatalogNumber:
AB48581
ChemicalName:
Methyl 5-amino-2-bromobenzoate
CasNumber:
6942-37-6
MolecularFormula:
C8H8BrNO2
MolecularWeight:
230.0586
MdlNumber:
MFCD00085568
Smiles:
COC(=O)c1cc(N)ccc1Br
Complexity:
174
Covalently-bondedUnitCount:
1
HeavyAtomCount:
12
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
1
RotatableBondCount:
2
Xlogp3:
2.8
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: CC(=O)O[C@@H]1O[C@@H]([C@H]([C@H]1OCc1ccccc1)OCc1ccccc1)COCc1ccccc1
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
CC(=O)O[C@@H]1O[C@@H]([C@H]([C@H]1OCc1ccccc1)OCc1ccccc1)COCc1ccccc1
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__