AH13989
66909-30-6 | 2-Chloro-5-methylnicotinic acid
Manufacturer: A2B Chem
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CatalogNumber
AH13989
ChemicalName
2-Chloro-5-methylnicotinic acid
CasNumber
66909-30-6
MolecularFormula
C7H6ClNO2
MolecularWeight
171.58103999999997
MdlNumber
MFCD07375371
Smiles
Cc1cnc(c(c1)C(=O)O)Cl
Complexity
163
Covalently-bondedUnitCount
1
HeavyAtomCount
11
HydrogenBondAcceptorCount
3
HydrogenBondDonorCount
1
RotatableBondCount
1
Xlogp3
1.7
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CatalogNumber: AH13989
ChemicalName: 2-Chloro-5-methylnicotinic acid
CasNumber: 66909-30-6
MolecularFormula: C7H6ClNO2
MolecularWeight: 171.58103999999997
MdlNumber: MFCD07375371
Smiles: Cc1cnc(c(c1)C(=O)O)Cl
Complexity: 163
Covalently-bondedUnitCount: 1
HeavyAtomCount: 11
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: 1
RotatableBondCount: 1
Xlogp3: 1.7
CatalogNumber:
AH13989
ChemicalName:
2-Chloro-5-methylnicotinic acid
CasNumber:
66909-30-6
MolecularFormula:
C7H6ClNO2
MolecularWeight:
171.58103999999997
MdlNumber:
MFCD07375371
Smiles:
Cc1cnc(c(c1)C(=O)O)Cl
Complexity:
163
Covalently-bondedUnitCount:
1
HeavyAtomCount:
11
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
1
RotatableBondCount:
1
Xlogp3:
1.7
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: COC1=CC=C(C=C1)NN.Cl
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
COC1=CC=C(C=C1)NN.Cl
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: NNC(=O)CNC(=O)OC(C)(C)C
Complexity: 198
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: -0.5
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
NNC(=O)CNC(=O)OC(C)(C)C
Complexity:
198
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
-0.5
CatalogNumber: AH13993
ChemicalName: 5-Methylmorpholin-3-one
CasNumber: 65922-85-2
MolecularFormula: C5H9NO2
MolecularWeight: 115.1305
MdlNumber: MFCD07781030
Smiles: CC1COCC(=O)N1
Complexity: 103
Covalently-bondedUnitCount: 1
HeavyAtomCount: 8
HydrogenBondAcceptorCount: 2
HydrogenBondDonorCount: 1
RotatableBondCount: __
Xlogp3: -0.4
CatalogNumber:
AH13993
ChemicalName:
5-Methylmorpholin-3-one
CasNumber:
65922-85-2
MolecularFormula:
C5H9NO2
MolecularWeight:
115.1305
MdlNumber:
MFCD07781030
Smiles:
CC1COCC(=O)N1
Complexity:
103
Covalently-bondedUnitCount:
1
HeavyAtomCount:
8
HydrogenBondAcceptorCount:
2
HydrogenBondDonorCount:
1
RotatableBondCount:
__
Xlogp3:
-0.4