Dodecylguanidine monohydrochloride

CAT: 0926-FD150850-01Size: 0.25 gDry Ice: NoHazardous: No

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CAT#:0926-FD150850-01Size:0.25 g

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CAS Number

13590-97-1

Synonyms

2-Dodecylguanidine hydrochloride

MDL Number

MFCD00072494

Molecular Formula

C13H30ClN3

Molecular Weight

263.85 g/mol

Controlled

Chemical Information

Dodecylguanidine hydrochloride

CAS Number	13590-97-1
PubChem CID	61649
IUPAC Name	2-dodecylguanidine;hydrochloride
Molecular Formula	C13H30ClN3
Molecular Weight	263.85
Topological Polar Surface Area	64.4
Hydrogen Bond Donor Count	3
Hydrogen Bond Acceptor Count	1
Rotatable Bond Count	11
Heavy Atom Count	17
Formal Charge	0
Complexity	163

SMILES

CCCCCCCCCCCCN=C(N)N.Cl

InChI

InChI=1S/C13H29N3.ClH/c1-2-3-4-5-6-7-8-9-10-11-12-16-13(14)15;/h2-12H2,1H3,(H4,14,15,16);1H

InChIKey

CGMKPKRNUNDACU-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 13590-97-1

CID: 61649

Formula: C13H30ClN3

MW: 263.85

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	263.85
Hydrogen Bond Donor Count	3
Hydrogen Bond Acceptor Count	1
Rotatable Bond Count	11
Exact Mass	263.2128257
Monoisotopic Mass	263.2128257
Topological Polar Surface Area	64.4 Å²
Heavy Atom Count	17
Formal Charge	0
Complexity	163
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	2
Compound Is Canonicalized	Yes

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