AB44648
4021-07-2 | 3-Methylpicolinic acid
Manufacturer: A2B Chem
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CatalogNumber
AB44648
ChemicalName
3-Methylpicolinic acid
CasNumber
4021-07-2
MolecularFormula
C7H7NO2
MolecularWeight
137.13598000000002
MdlNumber
MFCD00191553
Smiles
OC(=O)c1ncccc1C
NscNumber
109145
Complexity
136
Covalently-bondedUnitCount
1
HeavyAtomCount
10
HydrogenBondAcceptorCount
3
HydrogenBondDonorCount
1
RotatableBondCount
1
Xlogp3
1.1
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CatalogNumber: AB44648
ChemicalName: 3-Methylpicolinic acid
CasNumber: 4021-07-2
MolecularFormula: C7H7NO2
MolecularWeight: 137.13598000000002
MdlNumber: MFCD00191553
Smiles: OC(=O)c1ncccc1C
NscNumber: 109145
Complexity: 136
Covalently-bondedUnitCount: 1
HeavyAtomCount: 10
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: 1
RotatableBondCount: 1
Xlogp3: 1.1
CatalogNumber:
AB44648
ChemicalName:
3-Methylpicolinic acid
CasNumber:
4021-07-2
MolecularFormula:
C7H7NO2
MolecularWeight:
137.13598000000002
MdlNumber:
MFCD00191553
Smiles:
OC(=O)c1ncccc1C
NscNumber:
109145
Complexity:
136
Covalently-bondedUnitCount:
1
HeavyAtomCount:
10
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
1
RotatableBondCount:
1
Xlogp3:
1.1
CatalogNumber: AB44649
ChemicalName: 3-Picoline-4-boronic acid
CasNumber: 894808-72-1
MolecularFormula: C6H8BNO2
MolecularWeight: 136.9442
MdlNumber: MFCD10001421
Smiles: OB(c1ccncc1C)O
NscNumber: __
Complexity: 110
Covalently-bondedUnitCount: 1
HeavyAtomCount: 10
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: 2
RotatableBondCount: 1
Xlogp3: __
CatalogNumber:
AB44649
ChemicalName:
3-Picoline-4-boronic acid
CasNumber:
894808-72-1
MolecularFormula:
C6H8BNO2
MolecularWeight:
136.9442
MdlNumber:
MFCD10001421
Smiles:
OB(c1ccncc1C)O
NscNumber:
__
Complexity:
110
Covalently-bondedUnitCount:
1
HeavyAtomCount:
10
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
2
RotatableBondCount:
1
Xlogp3:
__
CatalogNumber: AB44650
ChemicalName: 3-Methylquinoline
CasNumber: 612-58-8
MolecularFormula: C10H9N
MolecularWeight: 143.1852
MdlNumber: MFCD00014661
Smiles: Cc1cnc2c(c1)cccc2
NscNumber: 109149
Complexity: 133
Covalently-bondedUnitCount: 1
HeavyAtomCount: 11
HydrogenBondAcceptorCount: 1
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: 2.5
CatalogNumber:
AB44650
ChemicalName:
3-Methylquinoline
CasNumber:
612-58-8
MolecularFormula:
C10H9N
MolecularWeight:
143.1852
MdlNumber:
MFCD00014661
Smiles:
Cc1cnc2c(c1)cccc2
NscNumber:
109149
Complexity:
133
Covalently-bondedUnitCount:
1
HeavyAtomCount:
11
HydrogenBondAcceptorCount:
1
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
2.5
CatalogNumber: AB44651
ChemicalName: 3-Methyltetrahydrofuran
CasNumber: 13423-15-9
MolecularFormula: C5H10O
MolecularWeight: 86.1323
MdlNumber: MFCD00005367
Smiles: CC1COCC1
NscNumber: 91487
Complexity: 43.2
Covalently-bondedUnitCount: 1
HeavyAtomCount: 6
HydrogenBondAcceptorCount: 1
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: 1
CatalogNumber:
AB44651
ChemicalName:
3-Methyltetrahydrofuran
CasNumber:
13423-15-9
MolecularFormula:
C5H10O
MolecularWeight:
86.1323
MdlNumber:
MFCD00005367
Smiles:
CC1COCC1
NscNumber:
91487
Complexity:
43.2
Covalently-bondedUnitCount:
1
HeavyAtomCount:
6
HydrogenBondAcceptorCount:
1
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
1