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1866-17-7 | ACETYL-BETA-(METHYLTHIO) CHOLINE IODIDE
CAS No: 1866-17-7 Catalog No: AG00AOYP MDL No:MFCD00038728
Product Description
Catalog Number:
AG00AOYP
Chemical Name:
ACETYL-BETA-(METHYLTHIO) CHOLINE IODIDE
CAS Number:
1866-17-7
MDL Number:
MFCD00038728
IUPAC Name:
2-acetylsulfanylpropyl(trimethyl)azanium;iodide
InChI:
InChI=1S/C8H18NOS.HI/c1-7(11-8(2)10)6-9(3,4)5;/h7H,6H2,1-5H3;1H/q+1;/p-1
InChI Key:
XFWLTEMLPVNWIJ-UHFFFAOYSA-M
EC Number:
217-476-2
Properties
Complexity:
140
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
303.015g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
303.202g/mol
Monoisotopic Mass:
303.015g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
42.4A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
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