1-(Benzyloxy)-2-bromo-3-methylbenzene - CAS 1381944-69-9
Catalog: |
BB061691 |
Product Name: |
1-(Benzyloxy)-2-bromo-3-methylbenzene |
CAS: |
1381944-69-9 |
Synonyms: |
1-(BENZYLOXY)-2-BROMO-3-METHYLBENZENE; 2-bromo-1-methyl-3-phenylmethoxybenzene; Benzene, 2-bromo-1-methyl-3-(phenylmethoxy)- |
IUPAC Name: | 2-bromo-1-methyl-3-phenylmethoxybenzene |
Description: | 1-(Benzyloxy)-2-bromo-3-methylbenzene |
Molecular Weight: | 277.16 |
Molecular Formula: | C14H13BrO |
Canonical SMILES: | CC1=C(C(=CC=C1)OCC2=CC=CC=C2)Br |
InChI: | InChI=1S/C14H13BrO/c1-11-6-5-9-13(14(11)15)16-10-12-7-3-2-4-8-12/h2-9H,10H2,1H3 |
InChI Key: | KMZLFHHLCFEZMT-UHFFFAOYSA-N |
Complexity: | 201 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 276.01498 |
Formal Charge: | 0 |
Heavy Atom Count: | 16 |
Hydrogen Bond Acceptor Count: | 1 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 276.01498 |
Rotatable Bond Count: | 3 |
Topological Polar Surface Area: | 9.2Ų |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 4.4 |
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