Methyl 3-(2-hydroxyphenyl)prop-2-enoate

HCID 89400
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Basic information

CAS
20883-98-1
Standard SMILES
COC(=O)C=Cc1ccccc1O
InChIKey
YMXREWKKROWOSO-UHFFFAOYSA-N
Molecular formula
C10H10O3
Average molar mass
178.18 g/mol
Monoisotopic mass
178.06299418

Names & identifiers

Preferred name
Methyl 3-(2-hydroxyphenyl)prop-2-enoate
IUPAC
methyl 3-(2-hydroxyphenyl)prop-2-enoate
English name
3-(2-HYDROXY-PHENYL)-ACRYLIC ACID METHYL ESTER
Molecular formula
C10H10O3
Molecular weight
178.18

Names & synonyms

methyl ortho-hydroxycinnamatemethyl 3-(2-hydroxyphenyl)prop-2-enoate20883-98-1methyl 2-hydroxycinnamatemethyl 3-(2-hydroxyphenyl)acrylateSCHEMBL63055DTXSID90943139YMXREWKKROWOSO-UHFFFAOYSA-Nmethyl 3-(2'-hydroxyphenyl)-2-propenateDB-045420Methyl o-coumarateMETHYL-C-COUMARATE
Show more names
METHYL 2-COUMARATEMethyl o-hydroxycinnamateMethyl ester of o-Hydroxycinnamic acidCinnamic acid, o-hydroxy-, methyl esterMethyl (2E)-3-(2-hydroxyphenyl)-2-propenoate3-(2-HYDROXY-PHENYL)-ACRYLIC ACID METHYL ESTER

Database identifiers

CAS
20883-98-1
PubChem CID
89400
DTXSID
DTXSID90943139

Properties

Computed structural properties

XLogP
1.8
Topological polar surface area
46.5 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
3
Rotatable bonds
3
Heavy atoms
13

Physicochemical properties

Melting point
119 · 119-120 °C
Boiling point
308.2 · 308.2±17.0 °C(Predicted)
Density
1 · 1+-.0.06 g/cm3(Predicted)
pka
8.56 · 8.56±0.30(Predicted)
LogP
2.19 · 2.190 (est)

Chemistry & industry

Suppliers7 total

上海麦克林生化科技股份有限公司021-50706066 15221275939 · [email protected]
武汉易泰科技有限公司上海分公司18930552037 · [email protected]
上海纳孚生物科技有限公司021-58952328 13125124762
烟台盛凯伦化学科技有限公司开发区第一分公司13356901049 · [email protected]
郑州安慕斯化工产品有限公司15981811963 18737195735 · [email protected]

Related reactions

22 records
New reaction record

Compound notes

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