AB49339
50866-30-3 | 5-Methylpyrazine-2-carbaldehyde
Manufacturer: A2B Chem
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CatalogNumber
AB49339
ChemicalName
5-Methylpyrazine-2-carbaldehyde
CasNumber
50866-30-3
MolecularFormula
C6H6N2O
MolecularWeight
122.1246
MdlNumber
MFCD10697792
Smiles
Cc1cnc(cn1)C=O
Complexity
105
Covalently-bondedUnitCount
1
HeavyAtomCount
9
HydrogenBondAcceptorCount
3
RotatableBondCount
1
Xlogp3
-0.1
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CatalogNumber: AB49339
ChemicalName: 5-Methylpyrazine-2-carbaldehyde
CasNumber: 50866-30-3
MolecularFormula: C6H6N2O
MolecularWeight: 122.1246
MdlNumber: MFCD10697792
Smiles: Cc1cnc(cn1)C=O
Complexity: 105
Covalently-bondedUnitCount: 1
HeavyAtomCount: 9
HydrogenBondAcceptorCount: 3
RotatableBondCount: 1
Xlogp3: -0.1
CatalogNumber:
AB49339
ChemicalName:
5-Methylpyrazine-2-carbaldehyde
CasNumber:
50866-30-3
MolecularFormula:
C6H6N2O
MolecularWeight:
122.1246
MdlNumber:
MFCD10697792
Smiles:
Cc1cnc(cn1)C=O
Complexity:
105
Covalently-bondedUnitCount:
1
HeavyAtomCount:
9
HydrogenBondAcceptorCount:
3
RotatableBondCount:
1
Xlogp3:
-0.1
CatalogNumber: AB49340
ChemicalName: 2-Chloro-4-methylbenzaldehyde
CasNumber: 50817-80-6
MolecularFormula: C8H7ClO
MolecularWeight: 154.5936
MdlNumber: MFCD10703515
Smiles: O=Cc1ccc(cc1Cl)C
Complexity: 124
Covalently-bondedUnitCount: 1
HeavyAtomCount: 10
HydrogenBondAcceptorCount: 1
RotatableBondCount: 1
Xlogp3: 2.4
CatalogNumber:
AB49340
ChemicalName:
2-Chloro-4-methylbenzaldehyde
CasNumber:
50817-80-6
MolecularFormula:
C8H7ClO
MolecularWeight:
154.5936
MdlNumber:
MFCD10703515
Smiles:
O=Cc1ccc(cc1Cl)C
Complexity:
124
Covalently-bondedUnitCount:
1
HeavyAtomCount:
10
HydrogenBondAcceptorCount:
1
RotatableBondCount:
1
Xlogp3:
2.4
CatalogNumber: AB49341
ChemicalName: 3-Boc-amino-2,6-dioxopiperidine
CasNumber: 31140-42-8
MolecularFormula: C10H16N2O4
MolecularWeight: 228.245
MdlNumber: MFCD08275101
Smiles: O=C1CCC(C(=O)N1)NC(=O)OC(C)(C)C
Complexity: 319
Covalently-bondedUnitCount: 1
HeavyAtomCount: 16
HydrogenBondAcceptorCount: 4
RotatableBondCount: 3
Xlogp3: 0.2
CatalogNumber:
AB49341
ChemicalName:
3-Boc-amino-2,6-dioxopiperidine
CasNumber:
31140-42-8
MolecularFormula:
C10H16N2O4
MolecularWeight:
228.245
MdlNumber:
MFCD08275101
Smiles:
O=C1CCC(C(=O)N1)NC(=O)OC(C)(C)C
Complexity:
319
Covalently-bondedUnitCount:
1
HeavyAtomCount:
16
HydrogenBondAcceptorCount:
4
RotatableBondCount:
3
Xlogp3:
0.2
CatalogNumber: AB49342
ChemicalName: 4-Aminobenzene-1,3-dicarboxylic acid
CasNumber: 33890-03-8
MolecularFormula: C8H7NO4
MolecularWeight: 181.1455
MdlNumber: MFCD00102008
Smiles: OC(=O)c1ccc(c(c1)C(=O)O)N
Complexity: 228
Covalently-bondedUnitCount: 1
HeavyAtomCount: 13
HydrogenBondAcceptorCount: 5
RotatableBondCount: 2
Xlogp3: 0.5
CatalogNumber:
AB49342
ChemicalName:
4-Aminobenzene-1,3-dicarboxylic acid
CasNumber:
33890-03-8
MolecularFormula:
C8H7NO4
MolecularWeight:
181.1455
MdlNumber:
MFCD00102008
Smiles:
OC(=O)c1ccc(c(c1)C(=O)O)N
Complexity:
228
Covalently-bondedUnitCount:
1
HeavyAtomCount:
13
HydrogenBondAcceptorCount:
5
RotatableBondCount:
2
Xlogp3:
0.5