530-40-5

530-40-5 structure

Name: N,N-Diethylisonicotinamide
Chemical Name: N,N-Diethylisonicotinamide
CAS Number: 530-40-5
Molecular Formula: C₁₀H₁₄N₂O
Molecular Weight: 178.23100
Create Date: 2018-03-15 08:00:00
Modify Date: 2025-08-25 12:06:16

Name	N,N-Diethylisonicotinamide
Synonyms	N,N-diethylisonocotamide N,N-diethyl-4-nicotamide isonicotinicaciddiethylamide N,N-Diethyl-4-pyridinecarboxamide Diethylisonicotinamide N,N-diethylpyridine-4-carboxamide n,n-diethyl-4-pyridinecarboxamid N,N-diethylnicotinamide N,N-diethyl-4-nicotinamide n,n-diethyl-isonicotinamid

Density	1.042g/cm3
Boiling Point	311.6ºC at 760mmHg
Molecular Formula	C₁₀H₁₄N₂O
Molecular Weight	178.23100
Flash Point	142.2ºC
Exact Mass	178.11100
PSA	33.20000
LogP	1.56360
Index of Refraction	1.52

CHEMICAL IDENTIFICATION

RTECS NUMBER :: NR9810000

CHEMICAL NAME :: Isonicotinamide, N,N-diethyl-

CAS REGISTRY NUMBER :: 530-40-5

BEILSTEIN REFERENCE NO. :: 0133559

LAST UPDATED :: 199709

DATA ITEMS CITED :: 1

MOLECULAR FORMULA :: C10-H14-N2-O

MOLECULAR WEIGHT :: 178.26

WISWESSER LINE NOTATION :: T6NJ DVN2&2

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 :: 320 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#00803

HS Code	2933399090

872-85-5

109-89-7

~99%

530-40-5

Literature: Wang, Xinbo; Wang, David Zhigang Tetrahedron, 2011 , vol. 67, # 19 p. 3406 - 3411

14254-57-0

109-89-7

~98%

530-40-5

Literature: Zhou, Jun; Li, Bo; Qian, Zhen-Chao; Shi, Bing-Feng Advanced Synthesis and Catalysis, 2014 , vol. 356, # 5 p. 1038 - 1046

55-22-1

109-89-7

530-40-5

Literature: Lepetit S.p.A. Patent: US2858317 , 1954 ;

1903-64-6

816-43-3

~70%

530-40-5

Literature: Epsztajn, Jan; Berski, Zbigniew; Brzezinski, Jacek Z.; Jozwiak, Andrzej Tetrahedron Letters, 1980 , vol. 21, p. 4739 - 4742

55-22-1

2283-11-6

~81%

530-40-5

Literature: Yakovleva, N. L.; Ivanova, S. N.; Balyakina, M. V.; Gunar, V. I. Pharmaceutical Chemistry Journal, 1980 , vol. 14, # 1 p. 54 - 57 Khimiko-Farmatsevticheskii Zhurnal, 1980 , vol. 14, # 1 p. 67 - 69

55-22-1

530-40-5

Literature: Zhou, Jun; Li, Bo; Qian, Zhen-Chao; Shi, Bing-Feng Advanced Synthesis and Catalysis, 2014 , vol. 356, # 5 p. 1038 - 1046

1570-45-2

2283-11-6

~42%

530-40-5

39178-35-3

109-89-7

530-40-5

Literature: Canonica et al. Annali di Chimica (Rome, Italy), 1955 , vol. 45, p. 205,213

Precursor 9
872-85-5 109-89-7 14254-57-0 55-22-1
1903-64-6 816-43-3 2283-11-6 1570-45-2
39178-35-3
DownStream 5
56970-92-4 1122-54-9 77924-15-3 6936-88-5
95389-83-6

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%

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