2-(Aminomethyl)-2,3-dihydrobenzofuran Hydrochloride - CAS 19997-54-7
Catalog: |
BB015436 |
Product Name: |
2-(Aminomethyl)-2,3-dihydrobenzofuran Hydrochloride |
CAS: |
19997-54-7 |
Synonyms: |
2,3-dihydrobenzofuran-2-ylmethanamine;hydrochloride; 2,3-dihydro-1-benzofuran-2-ylmethanamine;hydrochloride |
IUPAC Name: | 2,3-dihydro-1-benzofuran-2-ylmethanamine;hydrochloride |
Description: | 2-(Aminomethyl)-2,3-dihydrobenzofuran Hydrochloride (CAS# 19997-54-7) is a useful research chemical. |
Molecular Weight: | 185.65 |
Molecular Formula: | C9H12ClNO |
Canonical SMILES: | C1C(OC2=CC=CC=C21)CN.Cl |
InChI: | InChI=1S/C9H11NO.ClH/c10-6-8-5-7-3-1-2-4-9(7)11-8;/h1-4,8H,5-6,10H2;1H |
InChI Key: | VLQHTBMTNLHCAE-UHFFFAOYSA-N |
Boiling Point: | 256.3 °C at 760 mmHg |
MDL: | MFCD01659957 |
LogP: | 2.45110 |
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 |
EP-2935217-A1 | Histone demethylase inhibitors | 20121221 |
US-2014213591-A1 | Histone demethylase inhibitors | 20121221 |
US-2015119397-A1 | Histone demethylase inhibitors | 20121221 |
US-2015291529-A1 | Histone demethylase inhibitors | 20121221 |
US-2016115131-A1 | Histone demethylase inhibitors | 20121221 |
Complexity: | 138 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 2 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 185.0607417 |
Formal Charge: | 0 |
Heavy Atom Count: | 12 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 2 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 185.0607417 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 35.2 Å2 |
Undefined Atom Stereocenter Count: | 1 |
Undefined Bond Stereocenter Count: | 0 |
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Amines and Anilines
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