Creatine methyl ester

Creatine methyl ester: Creatine methyl ester

IUPAC name

Methyl N-(aminoiminomethyl)-N-methylglycine

Identifiers

CAS number 341553-87-5,
132478-02-5 (HCl)

PubChem 11686929

ChemSpider 9861656^Y

Jmol-3D images Image 1
Image 2

SMILES

NC(N(C)CC(OC)=O)=N
O=C(OC)CN(C(=[N@H])N)C

InChI

InChI=1S/C5H11N3O2/c1-8(5(6)7)3-4(9)10-2/h3H2,1-2H3,(H3,6,7)^Y
Key: JQIVVNGNZVUVJC-UHFFFAOYSA-N^Y
InChI=1/C5H11N3O2/c1-8(5(6)7)3-4(9)10-2/h3H2,1-2H3,(H3,6,7)
Key: JQIVVNGNZVUVJC-UHFFFAOYAK

Properties

Molecular formula C₅H₁₁N₃O₂

Molar mass 145.16 g mol⁻¹

Y (verify) (what is: Y/N?)
Except where noted otherwise, data are given for materials in their standard state (at 25 °C, 100 kPa)

Infobox references

Creatine methyl ester is the methyl ester derivative of the amino acid creatine. It can be prepared by the esterification of creatine with methanol.^[1]

See also

Creatine ethyl ester

References

^ Process for preparation of creatine ester hydrochloride. Sun, Leda; Zhao, Qinhu; Liu, Ruirui. (2007) Chinese Patent: CN101066938

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Academic Dictionaries and Encyclopedias

Creatine methyl ester

IUPAC name Methyl N-(aminoiminomethyl)-N-methylglycine
Identifiers
CAS number	341553-87-5, 132478-02-5 (HCl)
PubChem	11686929
ChemSpider	9861656^Y
Jmol-3D images	Image 1 Image 2
SMILES NC(N(C)CC(OC)=O)=N O=C(OC)CN(C(=[N@H])N)C
InChI InChI=1S/C5H11N3O2/c1-8(5(6)7)3-4(9)10-2/h3H2,1-2H3,(H3,6,7)^Y Key: JQIVVNGNZVUVJC-UHFFFAOYSA-N^Y InChI=1/C5H11N3O2/c1-8(5(6)7)3-4(9)10-2/h3H2,1-2H3,(H3,6,7) Key: JQIVVNGNZVUVJC-UHFFFAOYAK
Properties
Molecular formula	C₅H₁₁N₃O₂
Molar mass	145.16 g mol⁻¹
Y (verify) (what is: Y/N?) Except where noted otherwise, data are given for materials in their standard state (at 25 °C, 100 kPa)
Infobox references