2-(4-Bromo-3-methylphenyl)pyrrolidine - CAS 1260675-29-3
Catalog: |
BB006347 |
Product Name: |
2-(4-Bromo-3-methylphenyl)pyrrolidine |
CAS: |
1260675-29-3 |
Synonyms: |
2-(4-bromo-3-methylphenyl)pyrrolidine; 2-(4-bromo-3-methylphenyl)pyrrolidine |
IUPAC Name: | 2-(4-bromo-3-methylphenyl)pyrrolidine |
Description: | 2-(4-Bromo-3-methylphenyl)pyrrolidine (CAS# 1260675-29-3) is a useful research chemical. |
Molecular Weight: | 240.14 |
Molecular Formula: | C11H14BrN |
Canonical SMILES: | CC1=C(C=CC(=C1)C2CCCN2)Br |
InChI: | InChI=1S/C11H14BrN/c1-8-7-9(4-5-10(8)12)11-3-2-6-13-11/h4-5,7,11,13H,2-3,6H2,1H3 |
InChI Key: | JFLBFTBAXZNXHS-UHFFFAOYSA-N |
GHS Hazard Statement: | H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral] |
Precautionary Statement: | P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P340, P305+P351+P338, P310, P312, P321, P330, P332+P313, P362, P403+P233, P405, and P501 |
Signal Word: | Danger |
Publication Number | Title | Priority Date |
WO-2020247475-A1 | Imidazo[1,2-c]pyrimidine derivatives as prc2 inhibitors for treating cancer | 20190605 |
WO-2020219448-A1 | Naphthyridine derivatives as prc2 inhibitors | 20190422 |
WO-2019152419-A1 | Prc2 inhibitors | 20180131 |
AU-2019214861-A1 | PRC2 inhibitors | 20180131 |
CN-112004816-A | PRC2 inhibitors | 20180131 |
Complexity: | 172 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 239.03096 |
Formal Charge: | 0 |
Heavy Atom Count: | 13 |
Hydrogen Bond Acceptor Count: | 1 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 239.03096 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 12 Å2 |
Undefined Atom Stereocenter Count: | 1 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2.9 |
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