HomeMCPWorkbenchSkills
HomeWorkbenchNotificationsMe
Huagongshe Open Program:[email protected]AI access: llms.txt · MCP GuidePrivacy Policy · Terms of Service · Supportv1.7.8
  1. Home
  2. /Compound

(4-(Benzyloxy)-3-fluorophenyl)methanol

HCID 21976875
NotesReactions
Basic informationNames & identifiersPropertiesSafety & regulationChemistry & industryRelated reactionsCompound notes
Substructure searchFind similar structures

Basic information

CAS
536974-94-4
Standard SMILES
OCc1ccc(OCc2ccccc2)c(F)c1
InChIKey
HWGIEIDBXWBVEB-UHFFFAOYSA-N
Molecular formula
C14H13FO2
Average molar mass
232.25 g/mol
Monoisotopic mass
232.08995788

Names & identifiers

Preferred name
(4-(Benzyloxy)-3-fluorophenyl)methanol
IUPAC
(3-fluoro-4-phenylmethoxyphenyl)methanol
English name
[4-(benzyloxy)-3-fluorophenyl]methanol
Molecular formula
C14H13FO2
Molecular weight
232.25

Names & synonyms

(4-(Benzyloxy)-3-fluorophenyl)methanol536974-94-4[4-(benzyloxy)-3-fluorophenyl]methanol(3-fluoro-4-phenylmethoxyphenyl)methanolMFCD11190327(4-benzyloxy-3-fluoro-phenyl)methanol4-benzyloxy-3-fluorobenzyl alcoholSCHEMBL1462187SCHEMBL29510827DTXSID10621028HWGIEIDBXWBVEB-UHFFFAOYSA-NAKOS015924617
Show more names
Benzenemethanol, 3-fluoro-4-(phenylmethoxy)-
AB87719(4-Benzyloxy-3-fluoro-phenyl)-methanolAS-35638DB-362089CS-0171387F301292

Database identifiers

CAS
536974-94-4
PubChem CID
21976875
DTXSID
DTXSID10621028
Nikkaji
J3.474.451C

Properties

Computed structural properties

XLogP
2.6
Topological polar surface area
29.5 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
3
Rotatable bonds
4
Heavy atoms
17
Formal charge
0
Complexity
216

Physicochemical properties

storage temp.
2 · 2-8°C
Symbol(GHS)
7 · GHS07
Signal word
Warning
Hazard statements
302 · H302-H315-H319-H335
Precautionary statements
261 · P261-P305+P351+P338

Safety & regulation

Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.

Safety data

Signal word
Warning
Symbol(GHS)
GHS07
Hazard statements
H302-H315-H319-H335
Precautionary statements
P261-P305+P351+P338

Chemistry & industry

Suppliers17 total

温州共赢化学有限公司+86-0086-577-64498589 +86-15355981851 · [email protected]
Allfluoro Pharmaceutical Company Limited+86-400-0216110 +86-15958047586 · [email protected]
烟台盛凯伦生物制品有限公司13356901049 · [email protected]
Aceschem Inc.+1-817863-6948 +1-(817)863-6948 · [email protected]
上海拓目化工有限公司13391076197 · [email protected]
南京代盟化工有限公司025-66800956 18800000000 · [email protected]
成都赛诺宁科技有限公司28-87999436 02887999436 · [email protected]
Henan Alfa Chemical Co., Ltd+8618339805032 · [email protected]
聊城莱博特生物医药科技有限公司0635-893290 · [email protected]
常州安赛普化工有限公司0519-86305871 13961213398 · [email protected]
河南阿尔法化工有限公司0371-55055611 18137792234 · [email protected]
Aromsyn Co., Ltd.+86-0571-85585865 +86-13336024896 · [email protected]
济南光尘医药科技有限公司18563726319 · [email protected]
武汉万鉴生物科技有限公司13277087647 · [email protected]

Related reactions

6 records
New reaction record
HRID 19931 reaction equation
HRID 19931As productuspto-grants-2010_06
HRID 19932 reaction equation
HRID 19932As reactantuspto-grants-2010_06
HRID 204115 reaction equation
HRID 204115As reactantTraining data from https://doi.org/10.1039/C8SC04228D (6/10)
HRID 901164 reaction equation
HRID 901164As productuspto-grants-2008_04
HRID 901165 reaction equation
HRID 901165As reactantuspto-grants-2008_04
HRID 1212882 reaction equation
HRID 1212882As productTraining data from https://doi.org/10.1039/C8SC04228D (5/10)

Compound notes

Loading…

On this pageBasic informationNames & identifiersPropertiesSafety & regulationChemistry & industryRelated reactionsCompound notes
江苏艾康生物医药研发有限公司17714375163 · [email protected]
Hefei TNJ Chemical Industry Co.,Ltd.+86-0551-65418684 +86-18949823763 · [email protected]
珠海奥博凯生物医药技术有限公司400-0628126 · [email protected]