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Merck
CN

29890

Cyclopropanecarboxylic acid

purum, ≥98.0% (T)

Synonym(s):

CPC-acid

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About This Item

Linear Formula:
C3H5CO2H
CAS Number:
Molecular Weight:
86.09
EC Number:
217-162-5
UNSPSC Code:
12352100
PubChem Substance ID:
Beilstein/REAXYS Number:
969839
MDL number:
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grade

purum

assay

≥98.0% (T)

refractive index

n20/D 1.438

bp

182-184 °C (lit.)

mp

14-17 °C (lit.)

density

1.081 g/mL at 25 °C (lit.)

SMILES string

OC(=O)C1CC1

InChI

1S/C4H6O2/c5-4(6)3-1-2-3/h3H,1-2H2,(H,5,6)

InChI key

YMGUBTXCNDTFJI-UHFFFAOYSA-N

pictograms

Corrosion

signalword

Danger

hcodes

Hazard Classifications

Skin Corr. 1B

Storage Class

8A - Combustible corrosive hazardous materials

wgk

WGK 3

flash_point_f

161.6 °F - closed cup

flash_point_c

72 °C - closed cup

ppe

Faceshields, Gloves, Goggles, type ABEK (EN14387) respirator filter

Regulatory Information

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H M Badawi et al.
Spectrochimica acta. Part A, Molecular and biomolecular spectroscopy, 71(4), 1540-1546 (2008-07-05)
The structural stability and internal rotations in cyclopropanecarboxylic acid and cyclopropanecarboxamide were investigated by the DFT-B3LYP and the ab initio MP2 calculations using 6-311G** and 6-311+G** basis sets. The computations were extended to the MP4//MP2/6-311G** and CCSD(T)//MP2/6-311G** single-point calculations. From
Tetsuo Toraya et al.
Applied and environmental microbiology, 70(1), 224-228 (2004-01-09)
A new strain isolated from soil utilizes cyclopropanecarboxylate as the sole source of carbon and energy and was identified as Rhodococcus rhodochrous (H. Nishihara, Y. Ochi, H. Nakano, M. Ando, and T. Toraya, J. Ferment. Bioeng. 80:400-402, 1995). A novel
Perali Ramu Sridhar et al.
Chemical communications (Cambridge, England), 48(5), 756-758 (2011-12-03)
A stereoselective methodology was developed for the construction of C-spiro-glycosides in two steps involving bromonium ion activated solvolytic ring opening of sugar derived 1,2-cyclopropanecarboxylates followed by a one-pot dehydrohalogenation, intramolecular hetero-Michael addition (IHMA) and ester hydrolysis. The obtained spirocyclic lactols
F X Sureda et al.
Neuroreport, 7(11), 1824-1828 (1996-07-29)
The effect of 1-aminocyclopropanecarboxylic acid (ACPC) on the potentiation by glycine of N-methyl-D-aspartate (NMDA)-evoked increases in intracellular free calcium concentration [Ca2+]i was examined in cultured rat cerebellar granule cells. NMDA (50 microM) produced a rapid and sustained increase in [Ca2+]i
G B Quistad et al.
Drug metabolism and disposition: the biological fate of chemicals, 14(5), 521-525 (1986-09-01)
Conjugation with carnitine is a major metabolic pathway for cyclopropanecarboxylic acid (CPCA). The CPCA-carnitine is cleaved enzymatically (carnitine acetyltransferase) more slowly in vitro than are acetyl- and propionylcarnitines, but also slightly more extensively. When given orally to a rat, CPCA-carnitine

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