AF36755
222970-60-7 | Methyl 5-amino-6-hydroxypyridine-3-carboxylate
Manufacturer: A2B Chem
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CatalogNumber
AF36755
ChemicalName
Methyl 5-amino-6-hydroxypyridine-3-carboxylate
CasNumber
222970-60-7
MolecularFormula
C7H8N2O3
MolecularWeight
168.15
MdlNumber
MFCD11053056
Smiles
COC(=O)c1cnc(c(c1)N)O
Complexity
291
Covalently-bondedUnitCount
1
HeavyAtomCount
12
HydrogenBondAcceptorCount
4
HydrogenBondDonorCount
2
RotatableBondCount
2
Xlogp3
-0.7
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CatalogNumber: AF36755
ChemicalName: Methyl 5-amino-6-hydroxypyridine-3-carboxylate
CasNumber: 222970-60-7
MolecularFormula: C7H8N2O3
MolecularWeight: 168.15
MdlNumber: MFCD11053056
Smiles: COC(=O)c1cnc(c(c1)N)O
Complexity: 291
Covalently-bondedUnitCount: 1
HeavyAtomCount: 12
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: 2
RotatableBondCount: 2
Xlogp3: -0.7
CatalogNumber:
AF36755
ChemicalName:
Methyl 5-amino-6-hydroxypyridine-3-carboxylate
CasNumber:
222970-60-7
MolecularFormula:
C7H8N2O3
MolecularWeight:
168.15
MdlNumber:
MFCD11053056
Smiles:
COC(=O)c1cnc(c(c1)N)O
Complexity:
291
Covalently-bondedUnitCount:
1
HeavyAtomCount:
12
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
2
RotatableBondCount:
2
Xlogp3:
-0.7
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: Fc1ccc(c(c1)c1ccccc1)C(=O)O
Complexity: 248
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: 3
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
Fc1ccc(c(c1)c1ccccc1)C(=O)O
Complexity:
248
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
3
CatalogNumber: AF36758
ChemicalName: 2-Bromo-4-t-butyl-1-isopropoxybenzene
CasNumber: 223768-39-6
MolecularFormula: C13H19BrO
MolecularWeight: 271.1934
MdlNumber: MFCD21609649
Smiles: CC(Oc1ccc(cc1Br)C(C)(C)C)C
Complexity: 195
Covalently-bondedUnitCount: 1
HeavyAtomCount: 15
HydrogenBondAcceptorCount: 1
HydrogenBondDonorCount: __
RotatableBondCount: 3
Xlogp3: 5.1
CatalogNumber:
AF36758
ChemicalName:
2-Bromo-4-t-butyl-1-isopropoxybenzene
CasNumber:
223768-39-6
MolecularFormula:
C13H19BrO
MolecularWeight:
271.1934
MdlNumber:
MFCD21609649
Smiles:
CC(Oc1ccc(cc1Br)C(C)(C)C)C
Complexity:
195
Covalently-bondedUnitCount:
1
HeavyAtomCount:
15
HydrogenBondAcceptorCount:
1
HydrogenBondDonorCount:
__
RotatableBondCount:
3
Xlogp3:
5.1
CatalogNumber: AF36759
ChemicalName: 1-tert-Butyl-4-(4-nitrophenyl)benzene
CasNumber: 279242-11-4
MolecularFormula: C16H17NO2
MolecularWeight: 255.3117
MdlNumber: MFCD03700807
Smiles: [O-][N+](=O)c1ccc(cc1)c1ccc(cc1)C(C)(C)C
Complexity: 300
Covalently-bondedUnitCount: 1
HeavyAtomCount: 19
HydrogenBondAcceptorCount: 2
HydrogenBondDonorCount: __
RotatableBondCount: 2
Xlogp3: 5.5
CatalogNumber:
AF36759
ChemicalName:
1-tert-Butyl-4-(4-nitrophenyl)benzene
CasNumber:
279242-11-4
MolecularFormula:
C16H17NO2
MolecularWeight:
255.3117
MdlNumber:
MFCD03700807
Smiles:
[O-][N+](=O)c1ccc(cc1)c1ccc(cc1)C(C)(C)C
Complexity:
300
Covalently-bondedUnitCount:
1
HeavyAtomCount:
19
HydrogenBondAcceptorCount:
2
HydrogenBondDonorCount:
__
RotatableBondCount:
2
Xlogp3:
5.5