1,3,7-Trichloronaphthalene

CAT: 0926-FT28415-01Size: 25 mgDry Ice: NoHazardous: No

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CAT#:0926-FT28415-01Size:25 mg

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CAS Number

55720-37-1

Synonyms

PCN 21

MDL Number

MFCD18382445

Smiles

C1=CC (=CC2=C (C=C (C=C21) Cl) Cl) Cl

Molecular Formula

C10H5Cl3

Molecular Weight

231.5 g/mol

Controlled

Chemical Information

Naphthalene, 1,3,7-trichloro-

CAS Number	55720-37-1
PubChem CID	92351
IUPAC Name	1,3,7-trichloronaphthalene
Molecular Formula	C10H5Cl3
Molecular Weight	231.5
XLogP	5.3
Topological Polar Surface Area	0
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	0
Rotatable Bond Count	0
Heavy Atom Count	13
Formal Charge	0
Complexity	183

SMILES

C1=CC(=CC2=C(C=C(C=C21)Cl)Cl)Cl

InChI

InChI=1S/C10H5Cl3/c11-7-2-1-6-3-8(12)5-10(13)9(6)4-7/h1-5H

InChIKey

CFEUGIGSIREATC-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 55720-37-1

CID: 92351

Formula: C10H5Cl3

MW: 231.5

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	231.5
XLogP3	5.3
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	0
Rotatable Bond Count	0
Exact Mass	229.945683
Monoisotopic Mass	229.945683
Topological Polar Surface Area	0 Å²
Heavy Atom Count	13
Formal Charge	0
Complexity	183
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	1
Compound Is Canonicalized	Yes

Catalog	Name
FO29717-01	1,1,1,3,5,7,7,7-Octamethyltetrasiloxane
BAA00005	1,1,3,3,5,5,7,7-Octamethyltetrasiloxane
FT112068	1,3,5-Triazatricyclo[3.3.1.1 (3.7) ]decan-7-amine
AAA10774-01	3,7-Dimethyloctane-1,7-diol
FT05891-01	1,3,7-Trimethylxanthine
FC19804-01	1- (3-Carboxypropyl) -3,7-dimethylxanthine
JBA42199-01	2-Azatricyclo[7.3.0.0,3,7]dodeca-1,3 (7),8-triene
FD22522-01	1,3-Dipropyl-7-methylxanthine
FD22274-01	3,7-Dimethyl-1-propargylxanthine
AAA10621	3,7-Dimethyl-1-octanol

Catalog	Name
TRC-T774065-250MG	1,3,7-Trichloronaphthalene
TRC-T798245-25MG	1,2,3-Trichloronaphthalene
TRC-T774070-250MG	2,3,6-Trichloronaphthalene
BW GC 0012-01	2,3,6-trichloronaphthalene-1,4-dione
HY-166909S	1,4,5-Trichloronaphthalene-13C10
sc-222761A	1,1,1,3,5,7,7,7-Octamethyltetrasiloxane
OR1027222-01	1,1,3,3,5,5,7,7-Octamethyl-1,7-Divinyltetrasiloxane
OR1075630-01	1,7-Dichloro-1,1,3,3,5,5,7,7-octamethyltetrasiloxane
AR-S01524-01	1,1,3,3,5,5,7,7-Octamethyl-1,7-Tetrasiloxanediol
OR1028282-01	1,1,3,3,5,5,7,7-Octamethyltetrasiloxane