1,2-thiazol-3-ylmethanamine - CAS 40064-68-4
Catalog: |
BB024276 |
Product Name: |
1,2-thiazol-3-ylmethanamine |
CAS: |
40064-68-4 |
Synonyms: |
3-isothiazolylmethanamine; 1,2-thiazol-3-ylmethanamine |
IUPAC Name: | 1,2-thiazol-3-ylmethanamine |
Description: | 1,2-thiazol-3-ylmethanamine (CAS# 40064-68-4) is a useful research chemical. |
Molecular Weight: | 114.166 |
Molecular Formula: | C4H6N2S |
Canonical SMILES: | C1=CSN=C1CN |
InChI: | InChI=1S/C4H6N2S/c5-3-4-1-2-7-6-4/h1-2H,3,5H2 |
InChI Key: | FJGCCKCEAWBXCV-UHFFFAOYSA-N |
Boiling Point: | 120 °C |
Density: | 1.239 g/cm3 |
LogP: | 1.30210 |
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-2020223255-A1 | 3-amino-4h-benzo[e][1,2,4]thiadiazine 1,1-dioxide derivatives as inhibitors of mrgx2 | 20190429 |
TW-202106669-A | 3-amino-4h-benzo[e][1,2,4]thiadiazine 1,1-dioxide derivatives as inhibitors of mrgx2 | 20190429 |
JP-2019529387-A | Lysyl oxidase-like 2 chemical probe and use thereof | 20160907 |
TW-201623295-A | Dihydrothiazide and indoline derivatives having BACE1 inhibitory activity | 20140411 |
WO-2015156421-A1 | Dihydrothiazine and dihydrooxazine derivatives having bace1 inhibitory activity | 20140411 |
Complexity: | 57.7 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 114.02516937 |
Formal Charge: | 0 |
Heavy Atom Count: | 7 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 114.02516937 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 67.2 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | -0.1 |
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Related Functional Groups
Oxazole/Thiazole
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