(2-(Benzyloxy)-5-bromophenyl)methanol

HCID 897136CAS 177759-46-5
Substructure searchFind similar structures

Basic information

Standard SMILES
OCc1cc(Br)ccc1OCc1ccccc1
InChIKey
AIDBRISXEJMHLS-UHFFFAOYSA-N
Molecular formula
C14H13BrO2
Average molar mass
293.15 g/mol
Monoisotopic mass
292.00989176

Names & identifiers

Preferred name
(2-(Benzyloxy)-5-bromophenyl)methanol
IUPAC
(5-bromo-2-phenylmethoxyphenyl)methanol
English name
[2-(Benzyloxy)-5-bromophenyl]methanol
Molecular formula
C14H13BrO2
Molecular weight
293.16

Names & synonyms

177759-46-5(2-(Benzyloxy)-5-bromophenyl)methanol2-Benzylox-5-bromobenzyl alcohol(5-bromo-2-phenylmethoxyphenyl)methanol[2-(benzyloxy)-5-bromophenyl]methanolMFCD037161825-Bromo-2-(phenylmethoxy)benzenemethanol2-benzyloxy-5-bromobenzyl alcoholBenzenemethanol, 5-bromo-2-(phenylmethoxy)-2-Benzyloxy-5-bromo-benzyl alcoholSCHEMBL46802272-benzyloxy-5-bromobenzylalcohol
Show more names
DTXSID60358458AIDBRISXEJMHLS-UHFFFAOYSA-NAKOS003748742(2-benzyloxy-5-bromo-phenyl)-methanolBS-21834DA-32185(5-bromanyl-2-phenylmethoxy-phenyl)methanolCS-0210251

Database identifiers

CAS
177759-46-5
PubChem CID
897136
DTXSID
DTXSID60358458
Nikkaji
J2.381.791H

Properties

Computed structural properties

XLogP
3.2
Topological polar surface area
29.5 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
2
Rotatable bonds
4
Heavy atoms
17

Physicochemical properties

Boiling point
413.5 · 413.5±35.0 °C(Predicted)
Density
1.436 · 1.436±0.06 g/cm3(Predicted)
pka
14.11 · 14.11±0.10(Predicted)
Symbol(GHS)
7 · GHS07
Signal word
Warning
Hazard statements
302 · H302-H315-H319-H335

Safety & regulation

Safety data

Signal word
Warning
Symbol(GHS)
GHS07
Hazard statements
H302-H315-H319-H335
Precautionary statements
P280-P305+P351+P338

Chemistry & industry

Suppliers7 total

安耐吉化学&3A（安徽泽升科技有限公司）021-58432009 400-005-6266 · [email protected]
常州科化生物科技有限公司0519-68985668 13685222090 · [email protected]
上海贤鼎生物科技有限公司4009209199 · [email protected]
河南阿尔法化工有限公司0371-55051623 18137891487 · [email protected]
上海肯恩化学科技有限公司13701870891; 02152215958 · [email protected]

Related reactions

22 records
New reaction record

Linked notes

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