4-Bromo-2-methoxy-1-methylbenzene - CAS 67868-73-9
Catalog: |
BB033427 |
Product Name: |
4-Bromo-2-methoxy-1-methylbenzene |
CAS: |
67868-73-9 |
Synonyms: |
4-bromo-2-methoxy-1-methylbenzene; 4-bromo-2-methoxy-1-methylbenzene |
IUPAC Name: | 4-bromo-2-methoxy-1-methylbenzene |
Description: | 4-Bromo-2-methoxy-1-methylbenzene (CAS# 67868-73-9) is a useful research chemical. |
Molecular Weight: | 201.06 |
Molecular Formula: | C8H9BrO |
Canonical SMILES: | CC1=C(C=C(C=C1)Br)OC |
InChI: | InChI=1S/C8H9BrO/c1-6-3-4-7(9)5-8(6)10-2/h3-5H,1-2H3 |
InChI Key: | RAQYGVDRDNKTOM-UHFFFAOYSA-N |
MDL: | MFCD06797972 |
LogP: | 2.76610 |
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, P312, P321, P330, P332+P313, P337+P313, P362, P403+P233, P405, and P501 |
Signal Word: | Warning |
Publication Number | Title | Priority Date |
WO-2021154666-A1 | 1H-PYRAZOLO[4,3-d]PYRIMIDINE COMPOUNDS AS TOLL-LIKE RECEPTOR 7 (TLR7) AGONISTS | 20200127 |
WO-2021072167-A1 | Compositions and methods for in vivo synthesis of unnatural polypeptides | 20191010 |
WO-2021067313-A1 | Eukaryotic semi-synthetic organisms | 20190930 |
EP-3782997-A1 | Fused pyrimidine compounds and pharmaceutical compositions thereof for the treatment of fibrotic diseases | 20190819 |
WO-2020252262-A1 | Reagents and methods for replication, transcription, and translation in semi-synthetic organisms | 20190614 |
Complexity: | 105 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 199.98368 |
Formal Charge: | 0 |
Heavy Atom Count: | 10 |
Hydrogen Bond Acceptor Count: | 1 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 199.98368 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 9.2 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 3.5 |
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