Phosgeniminium Chloride

CAT: 0127-OR1028255-01Size: 250 mgDry Ice: NoHazardous: No

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CAT#:0127-OR1028255-01Size:250 mg

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CAS Number

33842-02-3

Synonyms

Dichloromethylidene (dimethyl) azanium; chloride

Purity

95%

Smiles

C[N+](=C(Cl)Cl)C.[Cl-]

Chemical Information

Phosgeniminium chloride

CAS Number	33842-02-3
PubChem CID	2723945
IUPAC Name	dichloromethylidene(dimethyl)azanium chloride
Molecular Formula	C3H6Cl3N
Molecular Weight	162.44
Topological Polar Surface Area	3
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	1
Rotatable Bond Count	0
Heavy Atom Count	7
Formal Charge	0
Complexity	68

SMILES

C[N+](=C(Cl)Cl)C.[Cl-]

InChI

InChI=1S/C3H6Cl2N.ClH/c1-6(2)3(4)5;/h1-2H3;1H/q+1;/p-1

InChIKey

NRNFKRFWZQQDMD-UHFFFAOYSA-M

Chemical Structure

2D Structure

CAS: 33842-02-3

CID: 2723945

Formula: C3H6Cl3N

MW: 162.44

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	162.44
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	1
Rotatable Bond Count	0
Exact Mass	160.956582
Monoisotopic Mass	160.956582
Topological Polar Surface Area	3 Å²
Heavy Atom Count	7
Formal Charge	0
Complexity	68.9
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

Catalog	Name
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BUP17362-01	Pralidoxime Chloride
BUP16902-01	Oxybutynin chloride
BUP16385	(±) -Hexanoylcarnitine chloride
BUP16007-01	Betaine chloride
BUP14745-01	Benzethonium chloride

Catalog	Name
189775-01	Phenyl Methanesulphonyl Chloride (α-Toluenesulphonyl Chloride; Phenylmethylsulphonyl Chloride)
3121825	Cupric chloride (Copper chloride)
sc-279274	Lithium chloride-potassium chloride
TRC-B188800-5G	Phenylacetyl Chloride(Benzeneacetyl Chloride)
3125225	Stannous chloride (tin chloride)
3123430	Manganous chloride (Manganese chloride)
53473813-100g	Hexadecyltrimethylammonium chloride (Cetyltrimethylammonium chloride)
D3727-25	Diphenyleneiodonium Chloride (DPI Chloride)
3121705	Copper chloride (Cupric chloride)
HY-W012954S-01	TMA chloride-d12 (chloride)