AI43539
1937280-83-5 | 6-(Hydroxyimino)methyl]-1H-indazol-3-amine
Manufacturer: A2B Chem
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CatalogNumber
AI43539
ChemicalName
6-(Hydroxyimino)methyl]-1H-indazol-3-amine
CasNumber
1937280-83-5
MolecularFormula
C8H8N4O
MolecularWeight
176.1753
MdlNumber
MFCD29035397
Smiles
O/N=C/c1ccc2c(c1)[nH]nc2N
Complexity
208
Covalently-bondedUnitCount
1
HeavyAtomCount
13
HydrogenBondAcceptorCount
4
HydrogenBondDonorCount
3
RotatableBondCount
1
UndefinedBondStereocenterCount
1
Xlogp3
0.9
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CatalogNumber: AI43539
ChemicalName: 6-(Hydroxyimino)methyl]-1H-indazol-3-amine
CasNumber: 1937280-83-5
MolecularFormula: C8H8N4O
MolecularWeight: 176.1753
MdlNumber: MFCD29035397
Smiles: O/N=C/c1ccc2c(c1)[nH]nc2N
Complexity: 208
Covalently-bondedUnitCount: 1
HeavyAtomCount: 13
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: 3
RotatableBondCount: 1
UndefinedBondStereocenterCount: 1
Xlogp3: 0.9
CatalogNumber:
AI43539
ChemicalName:
6-(Hydroxyimino)methyl]-1H-indazol-3-amine
CasNumber:
1937280-83-5
MolecularFormula:
C8H8N4O
MolecularWeight:
176.1753
MdlNumber:
MFCD29035397
Smiles:
O/N=C/c1ccc2c(c1)[nH]nc2N
Complexity:
208
Covalently-bondedUnitCount:
1
HeavyAtomCount:
13
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
3
RotatableBondCount:
1
UndefinedBondStereocenterCount:
1
Xlogp3:
0.9
CatalogNumber: AI43540
ChemicalName: 2-Fluoro-6-formylphenylboronic acid
CasNumber: 1938062-31-7
MolecularFormula: C7H6BFO3
MolecularWeight: 167.9301
MdlNumber: MFCD19981524
Smiles: O=Cc1cccc(c1B(O)O)F
Complexity: 165
Covalently-bondedUnitCount: 1
HeavyAtomCount: 12
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: 2
RotatableBondCount: 2
UndefinedBondStereocenterCount: __
Xlogp3: __
CatalogNumber:
AI43540
ChemicalName:
2-Fluoro-6-formylphenylboronic acid
CasNumber:
1938062-31-7
MolecularFormula:
C7H6BFO3
MolecularWeight:
167.9301
MdlNumber:
MFCD19981524
Smiles:
O=Cc1cccc(c1B(O)O)F
Complexity:
165
Covalently-bondedUnitCount:
1
HeavyAtomCount:
12
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
2
RotatableBondCount:
2
UndefinedBondStereocenterCount:
__
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: O=Nc1c([O-])ccc2c1ccc(c2)S(=O)(=O)[O-].O=Nc1c([O-])ccc2c1ccc(c2)S(=O)(=O)[O-].O=Nc1c([O-])ccc2c1ccc(c2)S(=O)(=O)[O-].[Na+].[Na+].[Na+].[Fe+3]
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
UndefinedBondStereocenterCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
O=Nc1c([O-])ccc2c1ccc(c2)S(=O)(=O)[O-].O=Nc1c([O-])ccc2c1ccc(c2)S(=O)(=O)[O-].O=Nc1c([O-])ccc2c1ccc(c2)S(=O)(=O)[O-].[Na+].[Na+].[Na+].[Fe+3]
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
UndefinedBondStereocenterCount:
__
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: CCS(=O)(=O)CCn1c(C)ncc1[N+](=O)[O-]
Complexity: 345
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
UndefinedBondStereocenterCount: __
Xlogp3: -0.4
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
CCS(=O)(=O)CCn1c(C)ncc1[N+](=O)[O-]
Complexity:
345
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
UndefinedBondStereocenterCount:
__
Xlogp3:
-0.4