AD48220
154016-48-5 | (5-Methyl-3-isoxazolyl)methylamine
Manufacturer: A2B Chem
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CatalogNumber
AD48220
ChemicalName
(5-Methyl-3-isoxazolyl)methylamine
CasNumber
154016-48-5
MolecularFormula
C5H8N2O
MolecularWeight
112.1298
MdlNumber
MFCD02681995
Smiles
Cc1cc(no1)CN
Complexity
76.8
Covalently-bondedUnitCount
1
HeavyAtomCount
8
HydrogenBondAcceptorCount
3
HydrogenBondDonorCount
1
RotatableBondCount
1
Xlogp3
-0.3
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CatalogNumber: AD48220
ChemicalName: (5-Methyl-3-isoxazolyl)methylamine
CasNumber: 154016-48-5
MolecularFormula: C5H8N2O
MolecularWeight: 112.1298
MdlNumber: MFCD02681995
Smiles: Cc1cc(no1)CN
Complexity: 76.8
Covalently-bondedUnitCount: 1
HeavyAtomCount: 8
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: 1
RotatableBondCount: 1
Xlogp3: -0.3
CatalogNumber:
AD48220
ChemicalName:
(5-Methyl-3-isoxazolyl)methylamine
CasNumber:
154016-48-5
MolecularFormula:
C5H8N2O
MolecularWeight:
112.1298
MdlNumber:
MFCD02681995
Smiles:
Cc1cc(no1)CN
Complexity:
76.8
Covalently-bondedUnitCount:
1
HeavyAtomCount:
8
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
1
RotatableBondCount:
1
Xlogp3:
-0.3
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: NCc1noc(c1)c1ccccc1
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
NCc1noc(c1)c1ccccc1
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: AD48224
ChemicalName: 4,6-Dichloro-5-fluoronicotinic acid
CasNumber: 154012-18-7
MolecularFormula: C6H2Cl2FNO2
MolecularWeight: 209.99
MdlNumber: MFCD18256593
Smiles: OC(=O)c1cnc(c(c1Cl)F)Cl
Complexity: 192
Covalently-bondedUnitCount: 1
HeavyAtomCount: 12
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: 1
RotatableBondCount: 1
Xlogp3: 2.1
CatalogNumber:
AD48224
ChemicalName:
4,6-Dichloro-5-fluoronicotinic acid
CasNumber:
154012-18-7
MolecularFormula:
C6H2Cl2FNO2
MolecularWeight:
209.99
MdlNumber:
MFCD18256593
Smiles:
OC(=O)c1cnc(c(c1Cl)F)Cl
Complexity:
192
Covalently-bondedUnitCount:
1
HeavyAtomCount:
12
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
1
RotatableBondCount:
1
Xlogp3:
2.1
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: S=C=Nc1ccc(cc1)SSc1ccc(cc1)N=C=S
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
S=C=Nc1ccc(cc1)SSc1ccc(cc1)N=C=S
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__