315-18-4

Molecule structure of 4-(Dimethylamine)-3,5-xylyl-N-methyl-carbamate (CAS NO.315-18-4) :

IUPAC Name: [4-(dimethylamino)-3,5-dimethylphenyl] N-methylcarbamate 
Molecular Weight: 222.28352 g/mol
Molecular Formula: C₁₂H₁₈N₂O₂ 
Density: 1.076 g/cm³ 
Melting Point: 85 deg C
Boiling Point: 318.3 °C at 760 mmHg 
Flash Point: 146.3 °C
Molar Volume: 206.4 cm³
Polarizability: 25.82*10^-24 cm³
Surface Tension: 38.4 dyne/cm 
Enthalpy of Vaporization: 55.97 kJ/mol 
log P (octanol-water): 2.56
Water Solubility: 100 mg/L
Vapor Pressure: 2.70E-04 mm Hg
Henry's Law Constant: 7.90E-08 atm-m³/mole
Atmospheric OH Rate Constant: 2.90E-11 cm³/molecule-sec
XLogP3: 2.5
H-Bond Donor: 1
H-Bond Acceptor: 3
Rotatable Bond Count: 3
Tautomer Count: 2
Exact Mass: 222.136828
MonoIsotopic Mass: 222.136828
Topological Polar Surface Area: 41.6
Heavy Atom Count: 16
Complexity: 231
Canonical SMILES: CC1=CC(=CC(=C1N(C)C)C)OC(=O)NC
InChI: InChI=1S/C12H18N2O2/c1-8-6-10(16-12(15)13-3)7-9(2)11(8)14(4)5/h6-7H,1-5H3,(H,13,15)
InChIKey: YNEVBPNZHBAYOA-UHFFFAOYSA-N
EINECS: 206-249-3
Product Categories: Alphabetic; Analytical Standards; Z 
Storage temp.: 0-6 °C

 4-(Dimethylamine)-3,5-xylyl-N-methyl-carbamate (CAS NO.315-18-4) is used as a pesticide.

IARC Cancer Review: Group 3 IMEMDT    IARC Monographs on the Evaluation of Carcinogenic Risk of Chemicals to Man . 7 ,1987,p. 56.(World Health Organization, Internation Agency for Research on Cancer,Lyon, France.: ) (Single copies can be ordered from WHO Publications Centre U.S.A., 49 Sheridan Avenue, Albany, NY 12210) ; Animal Inadequate Evidence IMEMDT    IARC Monographs on the Evaluation of Carcinogenic Risk of Chemicals to Man . 12 ,1976,p. 237.(World Health Organization, Internation Agency for Research on Cancer,Lyon, France.: ) (Single copies can be ordered from WHO Publications Centre U.S.A., 49 Sheridan Avenue, Albany, NY 12210) . NCI Carcinogenesis Bioassay (feed); No Evidence: mouse, rat NCITR*    National Cancer Institute Carcinogenesis Technical Report Series. (Bethesda, MD 20014) No. NCI-CG-TR-147 ,1978. . EPA Extremely Hazardous Substances List.

Poison by ingestion, skin contact, and intraperitoneal routes. Experimental teratogenic effects. Questionable carcinogen with experimental neoplastigenic data. When heated to decomposition it emits toxic fumes of NO_x. See also ESTERS and CARBAMATES.
 

Hazard Codes: T+, N
Risk Statements: 21-28-50/53
R21: Harmful in contact with skin 
R28: Very toxic if swallowed 
R50/53: Very toxic to aquatic organisms, may cause long-term adverse effects in the aquatic environment
Safety Statements: 36/37-45-60-61
S36/37: Wear suitable protective clothing and gloves 
S45: In case of accident or if you feel unwell, seek medical advice immediately (show the label whenever possible) 
S60: This material and its container must be disposed of as hazardous waste 
S61: Avoid release to the environment. Refer to special instructions / safety data sheets
RIDADR: 2757
RTECS: FC0700000
HazardClass: 6.1(a)
PackingGroup: II

 4-(Dimethylamine)-3,5-xylyl-N-methyl-carbamate (CAS NO.315-18-4) is also called 3,5-Dimethyl-4-(dimethylamino)phenyl methylcarbamate ; 3,5-Xylenol, 4-(dimethylamino)-, methylcarbamate ; 4-(Dimethylamino)-3,5-dimethylphenol methylcarbamate (ester) ; Carbamate, 4-dimethylamino-3,5-xylyl N-methyl- ; Carbamic acid, methyl-, 4-(dimethylamino)-3,5-dimethylphenyl ester ; Carbamic acid, methyl-, 4-(dimethylamino)-3,5-xylyl ester ; Methyl-4-dimethylamino-3,5-xylyl carbamate ; Methyl-4-dimethylamino-3,5-xylyl ester of carbamic acid ; Methylcarbamic acid, 4-(dimethylamino)-3,5-xylyl ester .  4-(Dimethylamine)-3,5-xylyl-N-methyl-carbamate is an odorless white crystalline solid dissolved in a liquid carrier.  4-(Dimethylamine)-3,5-xylyl-N-methyl-carbamate is toxic by inhalation, skin absorption, and/or ingestion. When heated to high temperatures  4-(Dimethylamine)-3,5-xylyl-N-methyl-carbamate may emit toxic oxides of nitrogen.  4-(Dimethylamine)-3,5-xylyl-N-methyl-carbamate will burn but  4-(Dimethylamine)-3,5-xylyl-N-methyl-carbamate is difficult to ignite.It is a carbamate ester-amine. Amines behave as chemical bases. Carbamates are chemically similar to, but more reactive than amides. Like amides they form polymers such as polyurethane resins. Carbamates are incompatible with strong acids and bases, and especially incompatible with strong reducing agents such as hydrides. Flammable gaseous hydrogen is produced by the combination of active metals or nitrides with carbamates. Strongly oxidizing acids, peroxides, and hydroperoxides are incompatible with carbamates. Fire may produce irritating or poisonous gases. Container may explode in heat of fire. Avoid decomposition in highly alkaline media. Subject to photo-decomposition in the solid state.