4-CHLOROPHENYLACETIC ACID

CAS No.
1878-66-6
CCD No.
CCD00004166
Formula
C8 H7 Cl O2
MolWeight
170.594

Basic Information

Product Name: 4-CHLOROPHENYLACETIC ACID
CAS: 1878-66-6
English Synonyms: 2-(P-CHLOROPHENYL)ACETIC ACID ; 2-(4-CHLOROPHENYL)ACETIC ACID ; P-CHLOROPHENYLACETIC ACID ; 4-CHLOROBENZENEACETIC ACID ; 4-CHLOROPHENYLACETIC ACID ; PCPA
MDL Number.: MFCD00004344
H bond acceptor: 2
H bond donor: 1
Smile: c1cc(ccc1CC(=O)O)Cl
InChi: InChI=1S/C8H7ClO2/c9-7-3-1-6(2-4-7)5-8(10)11/h1-4H,5H2,(H,10,11)
InChiKey: InChIKey=CDPKJZJVTHSESZ-UHFFFAOYSA-N

Property

Melting Point: 102-105 DEG C(LIT)/104-106℃
Comments: LEGAL INFORMATION: REAGENTPLUS IS A REGISTERED TRADEMARK OF SIGMA-ALDRICH CO LLC
OTHER NOTES: TANDEM MASS SPECTROMETRY DATA INDEPENDENTLY GENERATED BY SCRIPPS CENTER FOR METABOLOMICS IS AVAILABLE TO VIEW OR DOWNLOAD IN PDF 139262.PDF TESTED METABOLITES ARE FEATURED ON SCRIPPS CENTER FOR METABOLOMICS METLIN METABOLITE DATABASE. TO LEARN MORE, VISIT SIGMA.COM/METLIN
RTECS: AG0590000
UNSPSC: 12352100
WGK: 3
Specification: REAGENTPLUS(R)

Safety information

Symbol: GHS07 GHS07
Signal word: Warning
Hazard statements: H312-H332
Precautionary statements: P280
hazard symbol: Xn
Risk Code: R:20/21
Safe Code: S:36/37
WGK Germany: 3

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