2-(Piperidinocarbonyl)-Benzoic acid

Modify Date: 2024-01-14 15:16:18

2-(Piperidinocarbonyl)-Benzoic acid Structure
2-(Piperidinocarbonyl)-Benzoic acid structure
Common Name 2-(Piperidinocarbonyl)-Benzoic acid
CAS Number 20320-44-9 Molecular Weight 233.26300
Density 1.246g/cm3 Boiling Point 439.7ºC at 760 mmHg
Molecular Formula C13H15NO3 Melting Point N/A
MSDS N/A Flash Point 219.7ºC

 Names

Name 2-(piperidine-1-carbonyl)benzoic acid
Synonym More Synonyms

 Chemical & Physical Properties

Density 1.246g/cm3
Boiling Point 439.7ºC at 760 mmHg
Molecular Formula C13H15NO3
Molecular Weight 233.26300
Flash Point 219.7ºC
Exact Mass 233.10500
PSA 57.61000
LogP 1.94880
Vapour Pressure 1.66E-08mmHg at 25°C
Index of Refraction 1.59

 Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
DH6477500
CHEMICAL NAME :
Benzoic acid, o-(piperidinocarbonyl)-
CAS REGISTRY NUMBER :
20320-44-9
BEILSTEIN REFERENCE NO. :
0193956
LAST UPDATED :
199612
DATA ITEMS CITED :
1
MOLECULAR FORMULA :
C13-H15-N-O3
MOLECULAR WEIGHT :
233.29
WISWESSER LINE NOTATION :
T6NTJ AVR BVQ

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Intravenous
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
180 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
CSLNX* U.S. Army Armament Research & Development Command, Chemical Systems Laboratory, NIOSH Exchange Chemicals. (Aberdeen Proving Ground, MD 21010) Volume(issue)/page/year: NX#01126

 Safety Information

HS Code 2933399090

 Synthetic Route

~74%

2-(Piperidinocarbonyl)-Benzoic acid Structure

2-(Piperidinoca...

CAS#:20320-44-9

Literature: Sato, Ippei; Morihira, Koichiro; Inami, Hiroshi; Kubota, Hirokazu; Morokata, Tatsuaki; Suzuki, Keiko; Iura, Yosuke; Nitta, Aiko; Imaoka, Takayuki; Takahashi, Toshiya; Takeuchi, Makoto; Ohta, Mitsuaki; Tsukamoto, Shin-ichi Bioorganic and Medicinal Chemistry, 2008 , vol. 16, # 18 p. 8607 - 8618

 Precursor & DownStream

Precursor  2

DownStream  0

 Customs

HS Code 2933399090
Summary 2933399090. other compounds containing an unfused pyridine ring (whether or not hydrogenated) in the structure. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:20.0%

 Synonyms

N-Piperidino-phthalamidsaeure
Phthalsaeure-monopiperidid
2-(Piperidinocarbonyl)-Benzoic acid