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439118-80-6 | Acetonitrile, (1-methyl-2-imidazolidinylidene)-, (2E)- (9CI)
CAS No: 439118-80-6 Catalog No: AG00DMCX MDL No:
Product Description
Catalog Number:
AG00DMCX
Chemical Name:
Acetonitrile, (1-methyl-2-imidazolidinylidene)-, (2E)- (9CI)
CAS Number:
439118-80-6
IUPAC Name:
(2E)-2-(1-methylimidazolidin-2-ylidene)acetonitrile
InChI:
InChI=1S/C6H9N3/c1-9-5-4-8-6(9)2-3-7/h2,8H,4-5H2,1H3/b6-2+
InChI Key:
BLKQRQGYNVGYIL-QHHAFSJGSA-N
Properties
Complexity:
174
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
1
Exact Mass:
123.08g/mol
Formal Charge:
0
Heavy Atom Count:
9
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
123.159g/mol
Monoisotopic Mass:
123.08g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
39.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.3
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