(+) -cis-Permethrinic acid

CAT: 0926-FCA66740-02Size: 0.25 gDry Ice: NoHazardous: No

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CAT#:0926-FCA66740-02Size:0.25 g

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CAS Number

55667-40-8

Synonyms

1R-cis-Permethric acid

MDL Number

MFCD01735711

Smiles

CC1 (C (C1C (=O) O) C=C (Cl) Cl) C

Molecular Formula

C8H10Cl2O2

Molecular Weight

209.07 g/mol

Controlled

Chemical Information

1R-cis-Permethrinic acid

CAS Number	55667-40-8
PubChem CID	673647
IUPAC Name	trans-(1R,3R)-3-(2,2-dichloroethenyl)-2,2-dimethylcyclopropane-1-carboxylic acid
Molecular Formula	C8H10Cl2O2
Molecular Weight	209.07
XLogP	3.3
Topological Polar Surface Area	37.3
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	2
Heavy Atom Count	12
Formal Charge	0
Complexity	241

SMILES

CC1([C@H]([C@H]1C(=O)O)C=C(Cl)Cl)C

InChI

InChI=1S/C8H10Cl2O2/c1-8(2)4(3-5(9)10)6(8)7(11)12/h3-4,6H,1-2H3,(H,11,12)/t4-,6-/m0/s1

InChIKey

LLMLSUSAKZVFOA-NJGYIYPDSA-N

Chemical Structure

2D Structure

CAS: 55667-40-8

CID: 673647

Formula: C8H10Cl2O2

MW: 209.07

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	209.07
XLogP3	3.3
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	2
Exact Mass	208.0057849
Monoisotopic Mass	208.0057849
Topological Polar Surface Area	37.3 Å²
Heavy Atom Count	12
Formal Charge	0
Complexity	241
Isotope Atom Count	0
Defined Atom Stereocenter Count	2
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
FCA70109	1S-Trans-permethrinic acid
FM178485-01	Cis, cis-Muconic acid
FP182879	Cis-Permethrin
AAA58584-01	Cis-Aconitic acid
FP156974-01	Cis-Propenylphosphonic acid
RAA53372-01	Cis-Epoxysuccinic acid
BDA78495-01	Cis, cis-1,2,4-Cyclohexanetricarboxylic acid
FR27714-01	13-cis-Retinoic acid
FH24323-01	Cis-4-Hydroxycinnamic acid
FAA68470-01	Cis-5-Tetradecenoic acid

Catalog	Name
CS-T-84151	(+) -cis-Permethrinic Acid
TRC-P287710-100MG	(+)-cis-Permethrinic Acid
OR1078879-01	(+/-) -cis-Permethrinic Acid
TRC-P287700-500MG	rac-cis-Permethrinic Acid
TRC-D434300-10G	Permethrinic Acid (cis/trans mixture)
CS-T-39120	Trans-Permethrinic Acid
464472-01	Rac-trans-Permethrinic Acid
sc-478470	1R-trans-Permethrinic Acid
CS-T-84095	Permethrinic Acid Methyl Ester