S-Benzylcysteamine hydrochloride - CAS 22572-33-4
Catalog: |
BB017671 |
Product Name: |
S-Benzylcysteamine hydrochloride |
CAS: |
22572-33-4 |
Synonyms: |
2-benzylsulfanylethanamine;hydrochloride |
IUPAC Name: | 2-benzylsulfanylethanamine;hydrochloride |
Description: | S-Benzylcysteamine hydrochloride (CAS# 22572-33-4) is a useful research chemical. |
Molecular Weight: | 203.73 |
Molecular Formula: | C9H14ClNS |
Canonical SMILES: | C1=CC=C(C=C1)CSCCN.Cl |
InChI: | InChI=1S/C9H13NS.ClH/c10-6-7-11-8-9-4-2-1-3-5-9;/h1-5H,6-8,10H2;1H |
InChI Key: | XZXIWQYIVDFDSP-UHFFFAOYSA-N |
Boiling Point: | 270.5 °C at 760 mmHg |
Melting Point: | 126-127 °C (lit.) |
Purity: | 95 % |
MDL: | MFCD00191774 |
LogP: | 3.38080 |
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 |
Publication Number | Title | Priority Date |
WO-2017147410-A1 | Compounds that inhibit mcl-1 protein | 20160225 |
US-2020409221-A1 | Liquid crystal sensor | 20151118 |
US-2016018371-A1 | Detection of gas-phase analytes using liquid crystals | 20130313 |
US-2017212088-A1 | Detection of gas-phase analytes using liquid crystals | 20130313 |
US-9575037-B2 | Detection of gas-phase analytes using liquid crystals | 20130313 |
Complexity: | 89.6 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 2 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 203.0535483 |
Formal Charge: | 0 |
Heavy Atom Count: | 12 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 2 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 203.0535483 |
Rotatable Bond Count: | 4 |
Topological Polar Surface Area: | 51.3 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
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