AA31457
1256818-31-1 | 2,3-Dihydro-[1,4]dioxino[2,3-b]pyridine-7-carboxylic acid
Manufacturer: A2B Chem
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CatalogNumber
AA31457
ChemicalName
2,3-Dihydro-[1,4]dioxino[2,3-b]pyridine-7-carboxylic acid
CasNumber
1256818-31-1
MolecularFormula
C8H7NO4
MolecularWeight
181.14547999999994
MdlNumber
MFCD18250788
Smiles
OC(=O)c1cnc2c(c1)OCCO2
Complexity
208
Covalently-bondedUnitCount
1
HeavyAtomCount
13
HydrogenBondAcceptorCount
5
HydrogenBondDonorCount
1
RotatableBondCount
1
Xlogp3
0.4
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CatalogNumber: AA31457
ChemicalName: 2,3-Dihydro-[1,4]dioxino[2,3-b]pyridine-7-carboxylic acid
CasNumber: 1256818-31-1
MolecularFormula: C8H7NO4
MolecularWeight: 181.14547999999994
MdlNumber: MFCD18250788
Smiles: OC(=O)c1cnc2c(c1)OCCO2
Complexity: 208
Covalently-bondedUnitCount: 1
HeavyAtomCount: 13
HydrogenBondAcceptorCount: 5
HydrogenBondDonorCount: 1
RotatableBondCount: 1
Xlogp3: 0.4
CatalogNumber:
AA31457
ChemicalName:
2,3-Dihydro-[1,4]dioxino[2,3-b]pyridine-7-carboxylic acid
CasNumber:
1256818-31-1
MolecularFormula:
C8H7NO4
MolecularWeight:
181.14547999999994
MdlNumber:
MFCD18250788
Smiles:
OC(=O)c1cnc2c(c1)OCCO2
Complexity:
208
Covalently-bondedUnitCount:
1
HeavyAtomCount:
13
HydrogenBondAcceptorCount:
5
HydrogenBondDonorCount:
1
RotatableBondCount:
1
Xlogp3:
0.4
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: FC(c1nccc(c1)C(=O)O)F
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
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__
ChemicalName:
__
CasNumber:
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MolecularFormula:
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MolecularWeight:
__
MdlNumber:
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Smiles:
FC(c1nccc(c1)C(=O)O)F
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: C#Cc1ccc(nc1)C1CC1
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
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__
ChemicalName:
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CasNumber:
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MolecularFormula:
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MolecularWeight:
__
MdlNumber:
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Smiles:
C#Cc1ccc(nc1)C1CC1
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: COC(=O)c1n[nH]c2c1cc(F)cn2
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
COC(=O)c1n[nH]c2c1cc(F)cn2
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__