5-Bromo-1-methyl-3H-indene - CAS 119999-25-6
Catalog: |
BB071355 |
Product Name: |
5-Bromo-1-methyl-3H-indene |
CAS: |
119999-25-6 |
Synonyms: |
5-Bromo-1-methyl-3H-indene; 6-bromo-3-methyl-1H-indene; 1H-INDENE, 6-BROMO-3-METHYL- |
IUPAC Name: | 6-bromo-3-methyl-1H-indene |
Description: | 5-Bromo-1-methyl-3H-indene |
Molecular Weight: | 209.08 |
Molecular Formula: | C10H9Br |
Canonical SMILES: | CC1=CCC2=C1C=CC(=C2)Br |
InChI: | InChI=1S/C10H9Br/c1-7-2-3-8-6-9(11)4-5-10(7)8/h2,4-6H,3H2,1H3 |
InChI Key: | NOFYPTDQPJCKRF-UHFFFAOYSA-N |
Complexity: | 183 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 207.98876 |
Formal Charge: | 0 |
Heavy Atom Count: | 11 |
Hydrogen Bond Acceptor Count: | 0 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 207.98876 |
Rotatable Bond Count: | 0 |
Topological Polar Surface Area: | 0Ų |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 3.3 |
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