2-Benzylox-5-bromobenzyl alcohol - CAS 177759-46-5
Catalog: |
BB055394 |
Product Name: |
2-Benzylox-5-bromobenzyl alcohol |
CAS: |
177759-46-5 |
Synonyms: |
(2-(Benzyloxy)-5-bromophenyl)methanol; 2-Benzylox-5-bromobenzyl alcohol; (5-bromo-2-phenylmethoxyphenyl)methanol; [2-(benzyloxy)-5-bromophenyl]methanol; 2-Benzyloxy-5-bromo-benzyl alcohol; 2-benzyloxy-5-bromobenzylalcohol |
IUPAC Name: | (5-bromo-2-phenylmethoxyphenyl)methanol |
Description: | 2-Benzylox-5-bromobenzyl alcohol |
Molecular Weight: | 293.16 |
Molecular Formula: | C14H13BrO2 |
Canonical SMILES: | C1=CC=C(C=C1)COC2=C(C=C(C=C2)Br)CO |
InChI: | InChI=1S/C14H13BrO2/c15-13-6-7-14(12(8-13)9-16)17-10-11-4-2-1-3-5-11/h1-8,16H,9-10H2 |
InChI Key: | AIDBRISXEJMHLS-UHFFFAOYSA-N |
Complexity: | 216 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 292.00989 |
Formal Charge: | 0 |
Heavy Atom Count: | 17 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 292.00989 |
Rotatable Bond Count: | 4 |
Topological Polar Surface Area: | 29.5Ų |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 3.2 |
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