6-TRIFLUOROMETHYLCYCLOPHOSPHAMIDE

Modify Date: 2024-01-10 00:52:22

6-TRIFLUOROMETHYLCYCLOPHOSPHAMIDE Structure
6-TRIFLUOROMETHYLCYCLOPHOSPHAMIDE structure
 Common Name 6-TRIFLUOROMETHYLCYCLOPHOSPHAMIDE
CAS Number 57165-71-6 Molecular Weight 329.08400
Density 1.44g/cm3 Boiling Point 336.3ºC at 760 mmHg
Molecular Formula C8H14Cl2F3N2O2P Melting Point N/A
MSDS N/A Flash Point 157.2ºC

 Names

Name N,N-bis(2-chloroethyl)-2-oxo-6-(trifluoromethyl)-1,3,2λ5-oxazaphosphinan-2-amine
Synonym More Synonyms

 Chemical & Physical Properties

Density 1.44g/cm3
Boiling Point 336.3ºC at 760 mmHg
Molecular Formula C8H14Cl2F3N2O2P
Molecular Weight 329.08400
Flash Point 157.2ºC
Exact Mass 328.01200
PSA 51.38000
LogP 3.14370
Index of Refraction 1.464

 Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
RP6159000
CHEMICAL NAME :
2H-1,3,2-Oxazaphosphorine, tetrahydro-2-(bis(2-chloroethyl)amino)-6-trifluoromet hyl-, 2-oxide
CAS REGISTRY NUMBER :
57165-71-6
LAST UPDATED :
199612
DATA ITEMS CITED :
2
MOLECULAR FORMULA :
C8-H14-Cl2-F3-N2-O2-P
MOLECULAR WEIGHT :
329.11
WISWESSER LINE NOTATION :
T6MPOTJ BO BN2G2G DXFFF

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Intraperitoneal
SPECIES OBSERVED :
Rodent - rat
DOSE/DURATION :
224 mg/kg
TOXIC EFFECTS :
Tumorigenic - active as anti-cancer agent
REFERENCE :
JMCMAR Journal of Medicinal Chemistry. (American Chemical Soc., Distribution Office Dept. 223, POB POB 57136, West End Stn., Washington, DC 20037) V.6- 1963- Volume(issue)/page/year: 18,1106,1975
TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Intraperitoneal
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
400 mg/kg
TOXIC EFFECTS :
Tumorigenic - active as anti-cancer agent
REFERENCE :
JMCMAR Journal of Medicinal Chemistry. (American Chemical Soc., Distribution Office Dept. 223, POB POB 57136, West End Stn., Washington, DC 20037) V.6- 1963- Volume(issue)/page/year: 18,1106,1975

 Synthetic Route

Bis(2-chloroethyl)aminophosphonic dichloride structure

Bis(2-chloroeth...

CAS#:127-88-8

1-amino-3-hydroxy-4,4,4-trifluorobutane structure

1-amino-3-hydro...

CAS#:57165-84-1

~%

6-TRIFLUOROMETHYLCYCLOPHOSPHAMIDE Structure

6-TRIFLUOROMETH...

CAS#:57165-71-6

Literature: Farmer; Cox Journal of Medicinal Chemistry, 1975 , vol. 18, # 11 p. 1106 - 1110

 Precursor & DownStream

Precursor  2

DownStream  0

 Synonyms

6-Trifluoromethylcyclophosphamide
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