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489409

Sigma-Aldrich

Fluoromethane-13C

99 atom % 13C

Synonym(s):

Methyl-13C fluoride

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About This Item

Linear Formula:
13CH3F
CAS Number:
Molecular Weight:
35.03
MDL number:
UNSPSC Code:
12352101
PubChem Substance ID:
NACRES:
NA.12

vapor density

1.231 (vs air)

Quality Level

vapor pressure

44.2 atm ( 21.1 °C)

isotopic purity

99 atom % 13C

bp

−77.9 °C (lit.)

mp

−141.8 °C (lit.)

mass shift

M+1

SMILES string

[13CH3]F

InChI

1S/CH3F/c1-2/h1H3/i1+1

InChI key

NBVXSUQYWXRMNV-OUBTZVSYSA-N

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Packaging

100 mL quantity is packaged in a 25 mL Sure/Pac cylinder with brass 1/4" male NPT valve. Nominal gas pressure at 21ºC is 32 psig for 100 mL. This pressure is slightly above atmospheric pressure. Care must be taken when extracting this product from the cylinder.
This product may be available from bulk stock and can be packaged on demand. For information on pricing, availability and packaging, please contact Stable Isotopes Customer Service.

Recommended products

Brass hose adapter Z146811 or brass body mini gas regulator Z513539 is recommended.

Legal Information

Sure/Pac is a trademark of Sigma-Aldrich Co. LLC

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Pictograms

FlameGas cylinder

Signal Word

Danger

Hazard Statements

Precautionary Statements

Hazard Classifications

Flam. Gas 1 - Press. Gas Liquefied gas

Storage Class Code

2A - Gases

WGK

WGK 3

Flash Point(F)

Not applicable

Flash Point(C)

Not applicable

Personal Protective Equipment

dust mask type N95 (US), Eyeshields, Gloves

Certificates of Analysis (COA)

Search for Certificates of Analysis (COA) by entering the products Lot/Batch Number. Lot and Batch Numbers can be found on a product’s label following the words ‘Lot’ or ‘Batch’.

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Lingchun Song et al.
Chemistry (Weinheim an der Bergstrasse, Germany), 12(28), 7458-7466 (2006-07-29)
The recently developed (L. Song, W. Wu, Q. Zhang, S. Shaik, J. Phys. Chem. A 2004, 108, 6017) valence bond method coupled with a polarized continuum model (VBPCM) has been applied to the identity SN2 reaction of halides in the
Patrice L Jackson et al.
European journal of medicinal chemistry, 51, 42-51 (2012-03-16)
The x-ray crystal structure of 3-((5-methylisoxazol-3-yl)amino)-5-methylcyclohex-2-enone (12b) and 3-((5-methylisoxazolyl-3-yl)amino)-5,5-dimethylcyclohex-2-enone (12c) were determined and correlated to their anticonvulsant activity in mice and rats. A hypothesis for the toxicity of the analogs are advanced. In addition, a series of 5-methyl-N-(3-oxocyclohex-1-enyl)-isoxazole-3-carboxamides were synthesized
Li-Ping Hao et al.
Chemosphere, 84(9), 1194-1199 (2011-07-05)
The inhibitory effect of CH(3)F on methanogenesis in mesophilic anaerobic granules was tested at different concentrations (0-10% v/v, in the gas phase) and verified by the stable carbon isotopic signatures of CH(4) and CO(2). The results showed that the inhibitory
A R W McKellar et al.
The Journal of chemical physics, 135(12), 124511-124511 (2011-10-07)
Spectra of solid para-H(2) doped with CH(3)F at 1.8 K are studied in the ν(3) region (~1040 cm(-1)) using a quantum cascade laser source. As shown previously, residual ortho-H(2) in the sample (~1000 ppm) gives rise to distinct spectral features
Waldemar Hujo et al.
Physical chemistry chemical physics : PCCP, 13(31), 13942-13950 (2011-05-20)
Potential energy curves for five complexes with weak to medium strong hydrogen bonds have been computed with dispersion corrected DFT methods. The electronic density based vdW-DF2 and VV10 van der Waals density functionals have been tested, as well as an

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