3-Bromobenzyl alcohol

HCID 85141CAS 15852-73-0

Basic information

Standard SMILES
OCc1cccc(Br)c1
InChIKey
FSWNRRSWFBXQCL-UHFFFAOYSA-N
Molecular formula
C7H7BrO
Average molar mass
187.03 g/mol
Monoisotopic mass
185.96803

Names & identifiers

Preferred name
3-Bromobenzyl alcohol
IUPAC
(3-bromophenyl)methanol
English name
3-Bromobenzyl alcohol
Molecular formula
C7H7BrO
Molecular weight
187.03

Names & synonyms

3-Bromobenzyl alcohol15852-73-0Benzenemethanol, 3-bromo-3-BromobenzenemethanolEINECS 239-975-4DTXSID70166440RefChem:499310DTXCID8088931239-975-4InChI=1/C7H7BrO/c8-7-3-1-2-6(4-7)5-9/h1-4,9H,5H(3-Bromophenyl)methanolm-Bromobenzyl alcohol
Show more names
RARECHEM AL BD 00523-Bromobenzyl alcohol 98%3-Bromobenzyl alcohol,99%3-Bromobenzyl Alcohol >3-BroMobenzyl Alcohol, 97+%
MFCD00004629(3-bromophenyl)methan-1-ol3-Bromobenzylalcoholm-bromobenzylalcohol3-bromophenylmethanol3-bromophenyl-methanol3-bromo benzyl alcohol3- bromophenyl-methanol

Database identifiers

CAS
15852-73-0
PubChem CID
85141
DTXSID
DTXSID70166440
ChEMBL
CHEMBL2323842
EC Number
239-975-4
Nikkaji
J278J

Properties

Computed structural properties

XLogP
2
Topological polar surface area
20.2 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
1
Rotatable bonds
1
Heavy atoms
9

Physicochemical properties

Melting point
110 · 110-112
Boiling point
165 °C16 · 165 °C16 mm Hg(lit.)
Density
1.56 g/mL · 1.56 g/mL at 25 °C(lit.)
refractive index
20 · n20/D 1.584(lit.)
Flash point
230 °F · >230 °F
storage temp.
Sealed in dry,Room Temperature

Safety & regulation

GHS classification

GHS Classification · 6 items

This chemical does not meet GHS hazard criteria for 20% (1 of 5) of reports.

Warning

H302 (20%): Harmful if swallowed [Warning Acute toxicity, oral];H315 (60%): Causes skin irritation [Warning Skin corrosion/irritation];H319 (60%): Causes serious eye irritation [Warning Serious eye damage/eye irritation];H332 (20%): Harmful if inhaled [Warning Acute toxicity, inhalation];H335 (60%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation]

P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P317, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 5 reports by companies from 5 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.;Reported as not meeting GHS hazard criteria per 1 of 5 reports by companies.;There are 4 notifications provided by 4 of 5 reports by companies with hazard statement code(s).;Information may vary between notifications depending on impurities, additives, and other factors. The percentage value in parenthesis indicates the notified classification ratio from companies that provide hazard codes. Only hazard codes with percentage values above 10% are shown. For more detailed information, please visit ECHA C&L website.

Hazard information

Regulatory InformationBenzenemethanol, 3-bromo-: Does not have an individual approval but may be used under an appropriate group standard
Hazard Classes and CategoriesAcute Tox. 4 (20%);Skin Irrit. 2 (60%);Eye Irrit. 2A (60%);Acute Tox. 4 (20%);STOT SE 3 (60%)

Regulatory information

Regulatory InformationBenzenemethanol, 3-bromo-: Does not have an individual approval but may be used under an appropriate group standard

Safety data

PPE
Eyeshields, Gloves
wgk
3
hs_code
29062900
Signal word
Warning
Symbol(GHS)
GHS07
hazard_code
Xi

Chemistry & industry

Applications

Uses3-Bromobenzyl alcohol was employed in the preparation of tert-butyl 3-(3-bromophenyl)-2-cyanopropanoate and silyl ether.

Suppliers50 total

国药集团化学试剂有限公司86-21-63210123 · [email protected]
梯希爱(上海)化成工业发展有限公司021-67121386 · [email protected]
上海阿拉丁生化科技股份有限公司400-6206333 13167063860 · [email protected]
常州瀚轩生物科技有限公司18602598900,18605190599 18602598900 · [email protected]
爱斯特(成都)生物制药股份有限公司+86-28-85122536 85324413 · [email protected]

Related reactions

82 records

Linked notes

Loading…