AD88348
885518-82-1 | 3-Iodo-1H-indazole-6-carboxylic acid methyl ester
Manufacturer: A2B Chem
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CatalogNumber
AD88348
ChemicalName
3-Iodo-1H-indazole-6-carboxylic acid methyl ester
CasNumber
885518-82-1
MolecularFormula
C9H7IN2O2
MolecularWeight
302.0685
MdlNumber
MFCD07781616
Smiles
COC(=O)c1ccc2c(c1)[nH]nc2I
Complexity
237
Covalently-bondedUnitCount
1
HeavyAtomCount
14
HydrogenBondAcceptorCount
3
HydrogenBondDonorCount
1
RotatableBondCount
2
Xlogp3
2.1
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CatalogNumber: AD88348
ChemicalName: 3-Iodo-1H-indazole-6-carboxylic acid methyl ester
CasNumber: 885518-82-1
MolecularFormula: C9H7IN2O2
MolecularWeight: 302.0685
MdlNumber: MFCD07781616
Smiles: COC(=O)c1ccc2c(c1)[nH]nc2I
Complexity: 237
Covalently-bondedUnitCount: 1
HeavyAtomCount: 14
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: 1
RotatableBondCount: 2
Xlogp3: 2.1
CatalogNumber:
AD88348
ChemicalName:
3-Iodo-1H-indazole-6-carboxylic acid methyl ester
CasNumber:
885518-82-1
MolecularFormula:
C9H7IN2O2
MolecularWeight:
302.0685
MdlNumber:
MFCD07781616
Smiles:
COC(=O)c1ccc2c(c1)[nH]nc2I
Complexity:
237
Covalently-bondedUnitCount:
1
HeavyAtomCount:
14
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
1
RotatableBondCount:
2
Xlogp3:
2.1
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: OC(=O)c1n[nH]c2c1c(I)ccc2
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
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__
ChemicalName:
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CasNumber:
__
MolecularFormula:
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MolecularWeight:
__
MdlNumber:
__
Smiles:
OC(=O)c1n[nH]c2c1c(I)ccc2
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
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ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: COC(=O)c1cc(N)c2c(c1)[nH]nc2
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
COC(=O)c1cc(N)c2c(c1)[nH]nc2
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
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ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: Brc1cc(Br)c2c(c1)[nH]nc2C(=O)O
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
Brc1cc(Br)c2c(c1)[nH]nc2C(=O)O
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__