AG66063
636-44-2 | 2,5-Dimethyl-3-furoic acid
Manufacturer: A2B Chem
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CatalogNumber
AG66063
ChemicalName
2,5-Dimethyl-3-furoic acid
CasNumber
636-44-2
MolecularFormula
C7H8O3
MolecularWeight
140.1366
MdlNumber
MFCD00082181
Smiles
Cc1oc(c(c1)C(=O)O)C
NscNumber
170612
Complexity
144
Covalently-bondedUnitCount
1
HeavyAtomCount
10
HydrogenBondAcceptorCount
3
HydrogenBondDonorCount
1
RotatableBondCount
1
Xlogp3
1.3
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CatalogNumber: AG66063
ChemicalName: 2,5-Dimethyl-3-furoic acid
CasNumber: 636-44-2
MolecularFormula: C7H8O3
MolecularWeight: 140.1366
MdlNumber: MFCD00082181
Smiles: Cc1oc(c(c1)C(=O)O)C
NscNumber: 170612
Complexity: 144
Covalently-bondedUnitCount: 1
HeavyAtomCount: 10
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: 1
RotatableBondCount: 1
Xlogp3: 1.3
CatalogNumber:
AG66063
ChemicalName:
2,5-Dimethyl-3-furoic acid
CasNumber:
636-44-2
MolecularFormula:
C7H8O3
MolecularWeight:
140.1366
MdlNumber:
MFCD00082181
Smiles:
Cc1oc(c(c1)C(=O)O)C
NscNumber:
170612
Complexity:
144
Covalently-bondedUnitCount:
1
HeavyAtomCount:
10
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
1
RotatableBondCount:
1
Xlogp3:
1.3
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: C1=CC=C(C(=C1)S(=O)(=O)Cl)S(=O)(=O)Cl
NscNumber: __
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
C1=CC=C(C(=C1)S(=O)(=O)Cl)S(=O)(=O)Cl
NscNumber:
__
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: Brc1ccc(cc1)C1NC(=NC(=C1/C(=N/c1cccc(c1)Cl)/O)C)S
NscNumber: __
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
Brc1ccc(cc1)C1NC(=NC(=C1/C(=N/c1cccc(c1)Cl)/O)C)S
NscNumber:
__
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: CC(=O)Nc1ccc(cc1C)N
NscNumber: __
Complexity: 170
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: 0.7
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
CC(=O)Nc1ccc(cc1C)N
NscNumber:
__
Complexity:
170
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
0.7