1-[2-(Dimethylamino)ethyl]-1H-tetrazole-5-thiol - CAS 61607-68-9
Catalog: |
BB031191 |
Product Name: |
1-[2-(Dimethylamino)ethyl]-1H-tetrazole-5-thiol |
CAS: |
61607-68-9 |
Synonyms: |
1-[2-(dimethylamino)ethyl]-2H-tetrazole-5-thione |
IUPAC Name: | 1-[2-(dimethylamino)ethyl]-2H-tetrazole-5-thione |
Description: | 1-[2-(Dimethylamino)ethyl]-1H-tetrazole-5-thiol (CAS# 61607-68-9) is an impurity of Cefotiam, a semi-synthetic cephalosporin antibiotic. |
Molecular Weight: | 173.24 |
Molecular Formula: | C5H11N5S |
Canonical SMILES: | CN(C)CCN1C(=S)N=NN1 |
InChI: | InChI=1S/C5H11N5S/c1-9(2)3-4-10-5(11)6-7-8-10/h3-4H2,1-2H3,(H,6,8,11) |
InChI Key: | ODDAWJGQWOGBCX-UHFFFAOYSA-N |
Boiling Point: | 202.6 ℃ at 760 mmHg |
Density: | 1.36 g/cm3 |
LogP: | -0.47660 |
GHS Hazard Statement: | H315 (97.73%): 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 |
Publication Number | Title | Priority Date |
WO-2021210308-A1 | Cleaning fluid and cleaning method | 20200416 |
WO-2021210310-A1 | Processing liquid, chemical/mechanical polishing method, and semiconductor substrate processing method | 20200416 |
WO-2021205797-A1 | Cleaning solution for semiconductor substrate | 20200410 |
JP-2021150561-A | Abrasive and polishing method | 20200323 |
WO-2021166571-A1 | Treatment method and treatment solution for object of interest | 20200218 |
Complexity: | 178 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 173.07351655 |
Formal Charge: | 0 |
Heavy Atom Count: | 11 |
Hydrogen Bond Acceptor Count: | 4 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 173.07351655 |
Rotatable Bond Count: | 3 |
Topological Polar Surface Area: | 75.3 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.3 |
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