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91-97-4

91-97-4 structure
91-97-4 structure

Name 4,4'-Diisocyanato-3,3'-dimethyl-1,1'-biphenyl
Synonyms 4,4'-Diisocyanato-3,3'-dimethylbiphenyl
MFCD00019908
1,1'-Biphenyl, 4,4'-diisocyanato-3,3'-dimethyl-
EINECS 202-112-7
1-isocyanato-4-(4-isocyanato-3-methylphenyl)-2-methylbenzene
Density 1.1±0.1 g/cm3
Boiling Point 384.8±42.0 °C at 760 mmHg
Melting Point 70-72°C
Molecular Formula C16H12N2O2
Molecular Weight 264.279
Flash Point 158.8±33.2 °C
Exact Mass 264.089874
PSA 58.86000
LogP 5.03
Vapour Pressure 0.0±0.9 mmHg at 25°C
Index of Refraction 1.583

CHEMICAL IDENTIFICATION

RTECS NUMBER :
DV3960000
CHEMICAL NAME :
1,1'-Biphenyl, 4,4'-diisocyanato-3,3'-dimethyl-
CAS REGISTRY NUMBER :
91-97-4
BEILSTEIN REFERENCE NO. :
2743710
LAST UPDATED :
199803
DATA ITEMS CITED :
5
MOLECULAR FORMULA :
C16-H12-N2-O2
MOLECULAR WEIGHT :
264.30
WISWESSER LINE NOTATION :
OCNR B1 DR C1 DNCO

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 :
56 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#02412
TYPE OF TEST :
LD - Lethal dose
ROUTE OF EXPOSURE :
Unreported
SPECIES OBSERVED :
Mammal - species unspecified
DOSE/DURATION :
>5 gm/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
MTPEEI Meditsina Truda i Promyshlennaya Ekologiya. Industrial Medicine and Ecology. (Mezhdunarodnaya Kniga, ul.B. Yakimanka, 39 117049 Moscow, Russia) No.1- 1993- Volume(issue)/page/year: (7),37,1994
Hazard Codes Xn
RTECS DV3960000
HS Code 2929109000

~91%

91-97-4 structure

91-97-4

Literature: Butler; Alper Chemical Communications, 1998 , # 23 p. 2575 - 2576

~%

91-97-4 structure

91-97-4

Literature: Justus Liebigs Annalen der Chemie, , vol. 562, p. 75,1114
Precursor  2

DownStream  1

HS Code 2929109000
Summary 2929109000. other isocyanates. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:30.0%