Methyl 3-phenoxypropionate

HCID 347927CAS 7497-89-4
Substructure searchFind similar structures

Basic information

Standard SMILES
COC(=O)CCOc1ccccc1
InChIKey
VOLURMJMDOHTGE-UHFFFAOYSA-N
Molecular formula
C10H12O3
Average molar mass
180.2 g/mol
Monoisotopic mass
180.07864424

Names & identifiers

Preferred name
Methyl 3-phenoxypropionate
IUPAC
methyl 3-phenoxypropanoate
English name
3-Phenoxy propanoic acid methyl ester
Molecular formula
C10H12O3
Molecular weight
180.2

Names & synonyms

Methyl 3-phenoxypropionateRefChem:815633654-491-7Methyl 3-phenoxypropanoate7497-89-4Propanoic acid, 3-phenoxy-, methyl ester3-PHENOXY PROPANOIC ACID METHYL ESTERPropionic acid, 3-phenoxy-, methyl esterMethyl3-phenoxypropanoateNSC406851methyl-3-phenoxypropanoateMethyl 3-phenoxypropanoate #
Show more names
3-PHENOXY PROPANOIC ACI3-Phenoxypropionic acid methyl esterMethyl 3-Phenoxy Propanoic Acid Ester
SCHEMBL1811389SCHEMBL2446705SCHEMBL4589730SCHEMBL6554273SCHEMBL8974439DTXSID00324495AKOS008906721NSC-406851

Database identifiers

CAS
7497-89-4
PubChem CID
347927
DTXSID
DTXSID00324495
EC Number
654-491-7
Nikkaji
J81.409A

Properties

Computed structural properties

XLogP
1.8
Topological polar surface area
35.5 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
3
Rotatable bonds
5
Heavy atoms
13

Physicochemical properties

Boiling point
106 · 106-119 °C(Press: 5-10 Torr)
Density
1.1076 g/cm3 · 1.1076 g/cm3
storage temp.
2 · 2-8°C
Symbol(GHS)
7 · GHS07
Signal word
Warning
Hazard statements
319 · H319

Safety & regulation

GHS classification

GHS Classification · 4 items

Warning

H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]

P264+P265, P280, P305+P351+P338, and P337+P317 (click each P-code to see the statement)

Aggregated GHS information provided per 38 reports by companies from 1 notifications to the ECHA C&L Inventory.

Hazard information

Hazard Classes and CategoriesEye Irrit. 2 (100%)

Safety data

Signal word
Warning
Symbol(GHS)
GHS07
Hazard statements
H319
Precautionary statements
P264-P280-P305+P351+P338-P337+P313P

Chemistry & industry

Upstream & downstream products

Suppliers8 total

烟台正信新材料科技有限公司13854547682 13854547682 · [email protected]
赛纳斯特化学（欢迎点击联系）021-60343070
江苏艾康生物医药研发有限公司025-66061636 19370895928 · [email protected]
围场满族蒙古族自治县元合生物技术研发有限公司0314-7886310 18830416512 · [email protected]
武汉英诺川生物科技有限公司18502785028 · [email protected]

Related reactions

13 records
New reaction record

Linked notes

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