Nicotine Structure

Nicotine

  • Product NameNicotine
  • CAS54-11-5
  • CBNumberCB5293753
  • MFC10H14N2
    Lewis structure
  • MW162.23
  • EINECS200-193-3
  • MDL NumberMFCD00006369
  • MOL File54-11-5.mol
  • MSDS FileSDS

Chemical Properties

Melting point -80 °C
alpha  -166 º (c=neat)
Boiling point 243-248 °C
Density  1.010 g/mL at 20 °C(lit.)
vapor pressure  0.06 hPa (20 °C)
refractive index  n20/D 1.5265(lit.)
Flash point 215 °F
storage temp.  2-8°C
solubility  ethanol: 50 mg/mL
pka 8.02(at 25℃)
form  liquid
color  yellow
PH 10.2 (8.1g/l, H2O, 20°C)
explosive limit 0.7-4%(V)
Odor Threshold 0.011ppm
optical activity [α]20/D 169°(lit.)
Water Solubility  MISCIBLE
Sensitive  Air Sensitive & Hygroscopic
Merck  14,6524
BRN  82109
Henry's Law Constant 3.3×103 mol/(m3Pa) at 25℃, HSDB (2015)
Exposure limits ACGIH:TLV-TWA 0.002 ppm (0.013 mg/m3),inhalable fraction and vapor TLV-STEL,0.0075 ppm (0.05 mg/m3),inhalable fraction and vapor TLV-SL,0.003 mg/100 cm2
OSHA:PEL-TWA 0.5 mg/m3
NIOSH:REL-TWA 0.5 mg/m3
Major Application agriculture
cleaning products
cosmetics
food and beverages
personal care
pharmaceutical (small molecule)
InChI 1S/C10H14N2/c1-12-7-3-5-10(12)9-4-2-6-11-8-9/h2,4,6,8,10H,3,5,7H2,1H3/t10-/m0/s1
InChIKey SNICXCGAKADSCV-JTQLQIEISA-N
SMILES CN1CCC[C@H]1c2cccnc2
LogP 1.170
CAS DataBase Reference 54-11-5(CAS DataBase Reference)
EWG's Food Scores 3-7
NCI Dictionary of Cancer Terms nicotine; nicotine gum; nicotine patch
FDA UNII 6M3C89ZY6R
NCI Drug Dictionary nicotine
ATC code N07BA01
Proposition 65 List Nicotine
NIST Chemistry Reference 3-(2-(N-methylpyrrolidinyl))pyridine(54-11-5)
EPA Substance Registry System Nicotine (54-11-5)
UNSPSC Code 12352210
NACRES NA.77

Safety

Symbol(GHS) Corrosion (GHS05)Skull and Crossbones (GHS06)Environment (GHS09)
Signal wordDanger
Hazard statements H300+H310+H330-H315-H318-H411
Precautionary statements P262-P273-P280-P302+P352+P310-P304+P340+P310-P305+P351+P338
Hazard Codes  T+,N,Xn,F,Xi,T
Risk Statements  25-27-51/53-36-20/21/22-11-36/37/38-39/23/24/25-23/24/25-59-48/20-40-36/38-24-20/22-63
Safety Statements  7-16-36/37-45-61-36-26-37/39-59
OEB C
OEL TWA: 0.5 mg/m3 [skin]
RIDADR  UN 1654
WGK Germany  3
RTECS  QS5250000
Autoignition Temperature 240 °C
TSCA  TSCA listed
HazardClass  6.1
PackingGroup  II
HS Code  29399910
Storage Class 3 - Flammable liquids
Hazard Classifications Acute Tox. 3 Dermal
Acute Tox. 3 Inhalation
Acute Tox. 3 Oral
Flam. Liq. 2
STOT SE 1
Hazardous Substances Data 54-11-5(Hazardous Substances Data)
Toxicity LD50 in mice (mg/kg): 0.3 i.v.; 9.5 i.p.; 230 orally (Barlow, McLeod)
IDLA 5 mg/m3
NFPA 704:
1
3 0

Nicotine Price

Nicotine Chemical Properties,Usage,Production

Nicotine synthesis