AA99527
17689-42-8 | 2-((2-Hydroxyethoxy)carbonyl)benzoic acid
Manufacturer: A2B Chem
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CatalogNumber
AA99527
ChemicalName
2-((2-Hydroxyethoxy)carbonyl)benzoic acid
CasNumber
17689-42-8
MolecularFormula
C10H10O5
MolecularWeight
210.1834
MdlNumber
MFCD00517721
Smiles
OCCOC(=O)c1ccccc1C(=O)O
Complexity
238
Covalently-bondedUnitCount
1
HeavyAtomCount
15
HydrogenBondAcceptorCount
5
HydrogenBondDonorCount
2
RotatableBondCount
5
Xlogp3
0.4
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CatalogNumber: AA99527
ChemicalName: 2-((2-Hydroxyethoxy)carbonyl)benzoic acid
CasNumber: 17689-42-8
MolecularFormula: C10H10O5
MolecularWeight: 210.1834
MdlNumber: MFCD00517721
Smiles: OCCOC(=O)c1ccccc1C(=O)O
Complexity: 238
Covalently-bondedUnitCount: 1
HeavyAtomCount: 15
HydrogenBondAcceptorCount: 5
HydrogenBondDonorCount: 2
RotatableBondCount: 5
Xlogp3: 0.4
CatalogNumber:
AA99527
ChemicalName:
2-((2-Hydroxyethoxy)carbonyl)benzoic acid
CasNumber:
17689-42-8
MolecularFormula:
C10H10O5
MolecularWeight:
210.1834
MdlNumber:
MFCD00517721
Smiles:
OCCOC(=O)c1ccccc1C(=O)O
Complexity:
238
Covalently-bondedUnitCount:
1
HeavyAtomCount:
15
HydrogenBondAcceptorCount:
5
HydrogenBondDonorCount:
2
RotatableBondCount:
5
Xlogp3:
0.4
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: SCCCCCC(=O)O
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
SCCCCCC(=O)O
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: AA99531
ChemicalName: 4-Phenylthiomorpholine 1,1-dioxide
CasNumber: 17688-68-5
MolecularFormula: C10H13NO2S
MolecularWeight: 211.2807
MdlNumber: MFCD00100136
Smiles: O=S1(=O)CCN(CC1)c1ccccc1
Complexity: 261
Covalently-bondedUnitCount: 1
HeavyAtomCount: 14
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: __
RotatableBondCount: 1
Xlogp3: 0.9
CatalogNumber:
AA99531
ChemicalName:
4-Phenylthiomorpholine 1,1-dioxide
CasNumber:
17688-68-5
MolecularFormula:
C10H13NO2S
MolecularWeight:
211.2807
MdlNumber:
MFCD00100136
Smiles:
O=S1(=O)CCN(CC1)c1ccccc1
Complexity:
261
Covalently-bondedUnitCount:
1
HeavyAtomCount:
14
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
__
RotatableBondCount:
1
Xlogp3:
0.9
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: OC(C1CCCCC1)(C1CCCCC1)C1CCCCC1
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
OC(C1CCCCC1)(C1CCCCC1)C1CCCCC1
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__