2-Chloro-5-fluorobenzylamine - CAS 202522-23-4
Catalog: |
BB015736 |
Product Name: |
2-Chloro-5-fluorobenzylamine |
CAS: |
202522-23-4 |
Synonyms: |
(2-chloro-5-fluorophenyl)methanamine |
IUPAC Name: | (2-chloro-5-fluorophenyl)methanamine |
Description: | 2-Chloro-5-fluorobenzylamine (CAS# 202522-23-4) is a useful research chemical. |
Molecular Weight: | 159.59 |
Molecular Formula: | C7H7ClFN |
Canonical SMILES: | C1=CC(=C(C=C1F)CN)Cl |
InChI: | InChI=1S/C7H7ClFN/c8-7-2-1-6(9)3-5(7)4-10/h1-3H,4,10H2 |
InChI Key: | IGFBMQSUHFQVFE-UHFFFAOYSA-N |
Boiling Point: | 212.9 °C at 760 mmHg |
Purity: | 95 % |
Density: | 1.27 g/cm3 |
MDL: | MFCD06213626 |
LogP: | 2.63810 |
GHS Hazard Statement: | H301 (88.37%): Toxic if swallowed [Danger Acute toxicity, oral] |
Precautionary Statement: | P260, P264, P270, P280, P301+P310, P301+P330+P331, P303+P361+P353, P304+P340, P305+P351+P338, P310, P321, P330, P363, P405, and P501 |
Signal Word: | Danger |
Publication Number | Title | Priority Date |
US-2020405706-A1 | Tetrahydroquinoline derivatives as p2x7 receptor antagonists | 20170313 |
US-2021085667-A1 | Tetrahydroquinoline derivatives as p2x7 receptor antagonists | 20170313 |
US-11077100-B2 | Tetrahydroquinoline derivatives as P2X7 receptor antagonists | 20170313 |
WO-2017114275-A1 | Compound for inhibiting rock, preparation method and use of same | 20151231 |
US-10017512-B2 | Compounds and compositions useful for treating disorders related to NTRK | 20150826 |
Complexity: | 110 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 159.0251051 |
Formal Charge: | 0 |
Heavy Atom Count: | 10 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 159.0251051 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 26 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.5 |
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