Ethyl (4-chlorophenyl)(hydroxy)acetate

HCID 12373588CAS 13511-29-0
Substructure searchFind similar structures

Basic information

Standard SMILES
CCOC(=O)C(O)c1ccc(Cl)cc1
InChIKey
NMKKKUVPOGMEJL-UHFFFAOYSA-N
Molecular formula
C10H11ClO3
Average molar mass
214.64 g/mol
Monoisotopic mass
214.03967189

Names & identifiers

Preferred name
Ethyl (4-chlorophenyl)(hydroxy)acetate
IUPAC
ethyl 2-(4-chlorophenyl)-2-hydroxyacetate
English name
Ethyl (4-chlorophenyl)(hydroxy)acetate
Molecular formula
C10H11ClO3
Molecular weight
214.65

Names & synonyms

13511-29-0Ethyl (4-chlorophenyl)(hydroxy)acetateDTXSID40494969RefChem:341775DTXCID40445779ETHYL 2-(4-CHLOROPHENYL)-2-HYDROXYACETATEEthyl2-(4-chlorophenyl)-2-hydroxyacetateMFCD00068980(4-Chlorophenyl)-hydroxy-acetic acid ethyl esterethyl 4-chloromandelateSCHEMBL2798571NMKKKUVPOGMEJL-UHFFFAOYSA-N
Show more names
Ethyl 4-chloro-α-hydroxybenzeneacetateBenzeneacetic acid, 4-chloro-α-hydroxy-, ethyl ester
AR2858AKOS011496909Ethyl 4-chloro-a-hydroxybenzeneacetateAS-45461CS-0172266ethyl 2-(4-chlorophenyl)-2-hydroxy-acetate

Database identifiers

CAS
13511-29-0
PubChem CID
12373588
DTXSID
DTXSID40494969
Nikkaji
J2.307.053G

Properties

Computed structural properties

XLogP
2.2
Topological polar surface area
46.5 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
3
Rotatable bonds
4
Heavy atoms
14

Physicochemical properties

HS Code
2918199890 · 2918199890

Safety & regulation

Safety data

hs_code
2918199890

Chemistry & industry

Suppliers4 total

常州合晶化工有限公司85528066 13775048983 · [email protected]
Aromsyn Co., Ltd.+86-0571-85585865 +86-13336024896 · [email protected]
常州千艾生物科技有限公司051915240519135 13961152745 · [email protected]
珠海奥博凯生物医药技术有限公司400-0628126 · [email protected]

Related reactions

2 records
New reaction record

Linked notes

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