AB44117
22282-72-0 | 2-Oxo-1,2-dihydropyridine-4-carboxylic acid
Manufacturer: A2B Chem
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CatalogNumber
AB44117
ChemicalName
2-Oxo-1,2-dihydropyridine-4-carboxylic acid
CasNumber
22282-72-0
MolecularFormula
C6H5NO3
MolecularWeight
139.1088
MdlNumber
MFCD01318566
Smiles
Oc1nccc(c1)C(=O)O
NscNumber
132888
Complexity
239
Covalently-bondedUnitCount
1
HeavyAtomCount
10
HydrogenBondAcceptorCount
3
HydrogenBondDonorCount
2
RotatableBondCount
1
Xlogp3
-0.5
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CatalogNumber: AB44117
ChemicalName: 2-Oxo-1,2-dihydropyridine-4-carboxylic acid
CasNumber: 22282-72-0
MolecularFormula: C6H5NO3
MolecularWeight: 139.1088
MdlNumber: MFCD01318566
Smiles: Oc1nccc(c1)C(=O)O
NscNumber: 132888
Complexity: 239
Covalently-bondedUnitCount: 1
HeavyAtomCount: 10
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: 2
RotatableBondCount: 1
Xlogp3: -0.5
CatalogNumber:
AB44117
ChemicalName:
2-Oxo-1,2-dihydropyridine-4-carboxylic acid
CasNumber:
22282-72-0
MolecularFormula:
C6H5NO3
MolecularWeight:
139.1088
MdlNumber:
MFCD01318566
Smiles:
Oc1nccc(c1)C(=O)O
NscNumber:
132888
Complexity:
239
Covalently-bondedUnitCount:
1
HeavyAtomCount:
10
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
2
RotatableBondCount:
1
Xlogp3:
-0.5
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: OCC1COCCOCCOCCOCCO1
NscNumber: __
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
OCC1COCCOCCOCCOCCO1
NscNumber:
__
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: AB44119
ChemicalName: tert-Butyl 2-(hydroxymethyl)morpholine-4-carboxylate
CasNumber: 135065-69-9
MolecularFormula: C10H19NO4
MolecularWeight: 217.2622
MdlNumber: MFCD03426270
Smiles: OCC1OCCN(C1)C(=O)OC(C)(C)C
NscNumber: __
Complexity: 224
Covalently-bondedUnitCount: 1
HeavyAtomCount: 15
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: 1
RotatableBondCount: 3
Xlogp3: 0.1
CatalogNumber:
AB44119
ChemicalName:
tert-Butyl 2-(hydroxymethyl)morpholine-4-carboxylate
CasNumber:
135065-69-9
MolecularFormula:
C10H19NO4
MolecularWeight:
217.2622
MdlNumber:
MFCD03426270
Smiles:
OCC1OCCN(C1)C(=O)OC(C)(C)C
NscNumber:
__
Complexity:
224
Covalently-bondedUnitCount:
1
HeavyAtomCount:
15
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
1
RotatableBondCount:
3
Xlogp3:
0.1
CatalogNumber: AB44120
ChemicalName: 5-Bromo-2-hydroxymethylpyridine
CasNumber: 88139-91-7
MolecularFormula: C6H6BrNO
MolecularWeight: 188.0219
MdlNumber: MFCD04035597
Smiles: OCc1ccc(cn1)Br
NscNumber: __
Complexity: 89.1
Covalently-bondedUnitCount: 1
HeavyAtomCount: 9
HydrogenBondAcceptorCount: 2
HydrogenBondDonorCount: 1
RotatableBondCount: 1
Xlogp3: 0.7
CatalogNumber:
AB44120
ChemicalName:
5-Bromo-2-hydroxymethylpyridine
CasNumber:
88139-91-7
MolecularFormula:
C6H6BrNO
MolecularWeight:
188.0219
MdlNumber:
MFCD04035597
Smiles:
OCc1ccc(cn1)Br
NscNumber:
__
Complexity:
89.1
Covalently-bondedUnitCount:
1
HeavyAtomCount:
9
HydrogenBondAcceptorCount:
2
HydrogenBondDonorCount:
1
RotatableBondCount:
1
Xlogp3:
0.7