AB44119
135065-69-9 | tert-Butyl 2-(hydroxymethyl)morpholine-4-carboxylate
Manufacturer: A2B Chem
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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
Complexity
224
Covalently-bondedUnitCount
1
HeavyAtomCount
15
HydrogenBondAcceptorCount
4
HydrogenBondDonorCount
1
RotatableBondCount
3
UndefinedAtomStereocenterCount
1
Xlogp3
0.1
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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
Complexity: 224
Covalently-bondedUnitCount: 1
HeavyAtomCount: 15
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: 1
RotatableBondCount: 3
UndefinedAtomStereocenterCount: 1
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
Complexity:
224
Covalently-bondedUnitCount:
1
HeavyAtomCount:
15
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
1
RotatableBondCount:
3
UndefinedAtomStereocenterCount:
1
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
Complexity: 89.1
Covalently-bondedUnitCount: 1
HeavyAtomCount: 9
HydrogenBondAcceptorCount: 2
HydrogenBondDonorCount: 1
RotatableBondCount: 1
UndefinedAtomStereocenterCount: __
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
Complexity:
89.1
Covalently-bondedUnitCount:
1
HeavyAtomCount:
9
HydrogenBondAcceptorCount:
2
HydrogenBondDonorCount:
1
RotatableBondCount:
1
UndefinedAtomStereocenterCount:
__
Xlogp3:
0.7
CatalogNumber: AB44121
ChemicalName: 2-(Hydroxymethyl)isonicotinic acid
CasNumber: 915140-06-6
MolecularFormula: C7H7NO3
MolecularWeight: 153.1354
MdlNumber: MFCD11977439
Smiles: OCc1nccc(c1)C(=O)O
Complexity: 149
Covalently-bondedUnitCount: 1
HeavyAtomCount: 11
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: 2
RotatableBondCount: 2
UndefinedAtomStereocenterCount: __
Xlogp3: -0.5
CatalogNumber:
AB44121
ChemicalName:
2-(Hydroxymethyl)isonicotinic acid
CasNumber:
915140-06-6
MolecularFormula:
C7H7NO3
MolecularWeight:
153.1354
MdlNumber:
MFCD11977439
Smiles:
OCc1nccc(c1)C(=O)O
Complexity:
149
Covalently-bondedUnitCount:
1
HeavyAtomCount:
11
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
2
RotatableBondCount:
2
UndefinedAtomStereocenterCount:
__
Xlogp3:
-0.5
CatalogNumber: AB44122
ChemicalName: 2-Oxo-1,2-dihydropyridine-3-carboxylic acid
CasNumber: 609-71-2
MolecularFormula: C6H5NO3
MolecularWeight: 139.1088
MdlNumber: MFCD00010100
Smiles: OC(=O)c1cccnc1O
Complexity: 239
Covalently-bondedUnitCount: 1
HeavyAtomCount: 10
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: 2
RotatableBondCount: 1
UndefinedAtomStereocenterCount: __
Xlogp3: 0.5
CatalogNumber:
AB44122
ChemicalName:
2-Oxo-1,2-dihydropyridine-3-carboxylic acid
CasNumber:
609-71-2
MolecularFormula:
C6H5NO3
MolecularWeight:
139.1088
MdlNumber:
MFCD00010100
Smiles:
OC(=O)c1cccnc1O
Complexity:
239
Covalently-bondedUnitCount:
1
HeavyAtomCount:
10
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
2
RotatableBondCount:
1
UndefinedAtomStereocenterCount:
__
Xlogp3:
0.5