4-Bromo-3-fluoro-2-methylaniline - CAS 127408-03-1
Catalog: |
BB006800 |
Product Name: |
4-Bromo-3-fluoro-2-methylaniline |
CAS: |
127408-03-1 |
Synonyms: |
4-bromo-3-fluoro-2-methylaniline; 4-bromo-3-fluoro-2-methylaniline |
IUPAC Name: | 4-bromo-3-fluoro-2-methylaniline |
Description: | 4-Bromo-3-fluoro-2-methylaniline (CAS# 127408-03-1) is a useful research chemical. |
Molecular Weight: | 204.04 |
Molecular Formula: | C7H7BrFN |
Canonical SMILES: | CC1=C(C=CC(=C1F)Br)N |
InChI: | InChI=1S/C7H7BrFN/c1-4-6(10)3-2-5(8)7(4)9/h2-3H,10H2,1H3 |
InChI Key: | HOFKRNFFIGAFNE-UHFFFAOYSA-N |
Storage: | Keep in dark place, Sealed in dry, 2-8 ℃ |
LogP: | 3.06000 |
GHS Hazard Statement: | H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral] |
Precautionary Statement: | P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P312, P304+P340, P305+P351+P338, P312, P321, P322, P330, P332+P313, P337+P313, P362, P363, P403+P233, P405, and P501 |
Signal Word: | Warning |
Publication Number | Title | Priority Date |
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Complexity: | 120 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 202.97459 |
Formal Charge: | 0 |
Heavy Atom Count: | 10 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 202.97459 |
Rotatable Bond Count: | 0 |
Topological Polar Surface Area: | 26 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2.4 |
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Amines and Anilines
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