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1443981-32-5 | 1-{1,4-dioxaspiro[4.6]undecan-2-ylmethyl}guanidine hydroiodide
CAS No: 1443981-32-5 Catalog No: AG01A5IH MDL No:MFCD24842916
Product Description
Catalog Number:
AG01A5IH
Chemical Name:
1-{1,4-dioxaspiro[4.6]undecan-2-ylmethyl}guanidine hydroiodide
CAS Number:
1443981-32-5
Molecular Formula:
C11H22IN3O2
Molecular Weight:
355.2158
MDL Number:
MFCD24842916
IUPAC Name:
2-(1,4-dioxaspiro[4.6]undecan-3-ylmethyl)guanidine;hydroiodide
InChI:
InChI=1S/C11H21N3O2.HI/c12-10(13)14-7-9-8-15-11(16-9)5-3-1-2-4-6-11;/h9H,1-8H2,(H4,12,13,14);1H
InChI Key:
IOEINIDJEJAORL-UHFFFAOYSA-N
SMILES:
NC(=N)NCC1COC2(O1)CCCCCC2.I
Properties
Complexity:
256
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
355.076g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
355.22g/mol
Monoisotopic Mass:
355.076g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
82.9A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
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