Sodium 1-heptanesulfonate monohydrate - CAS 207300-90-1
Catalog: |
BB016235 |
Product Name: |
Sodium 1-heptanesulfonate monohydrate |
CAS: |
207300-90-1 |
Synonyms: |
sodium;heptane-1-sulfonate;hydrate |
IUPAC Name: | sodium;heptane-1-sulfonate;hydrate |
Description: | Sodium 1-heptanesulfonate monohydrate (CAS# 207300-90-1) is a useful research chemical in analytical study using surfactant-containing conversion reagents for determining hemoglobin. |
Molecular Weight: | 220.26 |
Molecular Formula: | C7H17NaO4S |
Canonical SMILES: | CCCCCCCS(=O)(=O)[O-].O.[Na+] |
InChI: | InChI=1S/C7H16O3S.Na.H2O/c1-2-3-4-5-6-7-11(8,9)10;;/h2-7H2,1H3,(H,8,9,10);;1H2/q;+1;/p-1 |
InChI Key: | XWZCREJRXRKIRQ-UHFFFAOYSA-M |
Appearance: | Crystalline |
MDL: | MFCD00149550 |
LogP: | 2.51850 |
GHS Hazard Statement: | H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation] |
Precautionary Statement: | P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, and P501 |
Signal Word: | Warning |
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Complexity: | 172 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 3 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 220.07452447 |
Formal Charge: | 0 |
Heavy Atom Count: | 13 |
Hydrogen Bond Acceptor Count: | 4 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 220.07452447 |
Rotatable Bond Count: | 6 |
Topological Polar Surface Area: | 66.6 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
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