3-Anilinorhodanine - CAS 13097-10-4
Catalog: |
BB048749 |
Product Name: |
3-Anilinorhodanine |
CAS: |
13097-10-4 |
Synonyms: |
3-Anilino-2-thioxo-1,3-thiazolidin-4-one; 4-Thiazolidinone, 3-(phenylamino)-2-thioxo-; 3-(phenylamino)-2-sulfanylidene-1,3-thiazolidin-4-one; 3-(phenylamino)-2-thioxo-1,3-thiazolidin-4-one; Phenylaminorhodanin; NSC91507; 3-(Phenylamino)-2-thioxo-4-thiazolidinone |
IUPAC Name: | 3-anilino-2-sulfanylidene-1,3-thiazolidin-4-one |
Description: | 3-Anilinorhodanine (CAS# 13097-10-4 ) is a useful research chemical. |
Molecular Weight: | 224.30 |
Molecular Formula: | C9H8N2OS2 |
Canonical SMILES: | C1C(=O)N(C(=S)S1)NC2=CC=CC=C2 |
InChI: | InChI=1S/C9H8N2OS2/c12-8-6-14-9(13)11(8)10-7-4-2-1-3-5-7/h1-5,10H,6H2 |
InChI Key: | SNRGCDPTDOAQEQ-UHFFFAOYSA-N |
Boiling Point: | 340.7±25.0 °C at 760 mmHg |
Purity: | 98 % by HPLC |
Density: | 1.5±0.1 g/cm3 |
GHS Hazard Statement: | H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]; H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]; H335 (100%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation] |
Precautionary Statement: | P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 |
Signal Word: | Warning |
Complexity: | 251 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 224.00780523 |
Formal Charge: | 0 |
Heavy Atom Count: | 14 |
Hydrogen Bond Acceptor Count: | 4 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 224.00780523 |
Rotatable Bond Count: | 2 |
Topological Polar Surface Area: | 89.7 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2.7 |
Online Inquiry
Customer Support
Customer Centered
Related Functional Groups
Thiazolines/Thiazolidines
Customers Also Viewed
INDUSTRY LEADERS TRUST OUR PRODUCTS