Product Name

  • Name

    DIBROMODULCITOL

  • EINECS
  • CAS No. 10318-26-0
  • Density 2.117g/cm3
  • Solubility Insoluble(<0.1g/100mL)
  • Melting Point 183-185
  • Formula C6H12 Br2 O4
  • Boiling Point 511.2°Cat760mmHg
  • Molecular Weight 307.967
  • Flash Point 263°C
  • Transport Information
  • Appearance
  • Safety Poison by ingestion. Moderately toxic by intraperitoneal route. Questionable carcinogen with experimental carcinogenic, neoplastigenic, and tumorigenic data. Human mutation data reported. An anti-cancer agent taken orally. When heated to decomposition it emits very toxic fumes of Br−.
  • Risk Codes
  • Molecular Structure Molecular Structure of 10318-26-0 (DIBROMODULCITOL)
  • Hazard Symbols
  • Synonyms 1,6-Dibromo-1,6-dideoxy-D-dulcitol;1,6-Dibromo-1,6-dideoxydulcitol; 1,6-Dibromodideoxydulcitol;1,6-Dibromodulcitol; DBD; DBD (alcohol); Dibromdulcit; Dibromodulcitol;Dibromogalactitol; Elobromol; Mitolactol; NCI C04795; NSC 104800
  • PSA 80.92000
  • LogP -0.78020

Dibromodulcitol Chemical Properties

Molecule structure of Dibromodulcitol (CAS NO.10318-26-0):

IUPAC Name: 1,6-Dibromohexane-2,3,4,5-tetrol 
Molecular Weight: 307.96508 g/mol 
Molecular Formula: C6H12Br2O4
Density: 2.117 g/cm3 
Boiling Point: 511.2 °C at 760 mmHg 
Flash Point: 263 °C
Index of Refraction: 1.622
Molar Refractivity: 51.28 cm3
Molar Volume: 145.4 cm3
Polarizability: 20.33×10-24 cm3
Surface Tension: 77.4 dyne/cm
Enthalpy of Vaporization: 90.04 kJ/mol
Vapour Pressure: 1.37E-12 mmHg at 25 °C
XLogP3: -0.3
H-Bond Donor: 4
H-Bond Acceptor: 4
Rotatable Bond Count: 5
Exact Mass: 307.908187
MonoIsotopic Mass: 305.910234
Topological Polar Surface Area: 80.9
Heavy Atom Count: 12
Complexity: 110
Canonical SMILES: C(C(C(C(C(CBr)O)O)O)O)Br
InChI: InChI=1S/C6H12Br2O4/c7-1-3(9)5(11)6(12)4(10)2-8/h3-6,9-12H,1-2H2
InChIKey of Dibromodulcitol (CAS NO.10318-26-0): VFKZTMPDYBFSTM-UHFFFAOYSA-N

Dibromodulcitol Toxicity Data With Reference

1.    

mmo-sat 100 µg/plate

     CRNGDP    Carcinogenesis. 3 (1982),333.
2.    

dnd-rat-ipr 110 mg/kg

     CBINA8    Chemico-Biological Interactions. 47 (1983),133.
3.    

bfa rat/sat 450 mg/kg

     CRNGDP    Carcinogenesis. 3 (1982),333.
4.    

sce-ham:oth 5500 ng/L

     CNREA8    Cancer Research. 43 (1983),4530.
5.    

dnd-mam:lym 150 mmol/L

     CBINA8    Chemico-Biological Interactions. 47 (1983),133.
6.    

orl-rat LD50:1000 mg/kg

     CCROBU    Cancer Chemotherapy Reports, Part 1. 56 (1972),593.
7.    

ipr-rat LD50:470 mg/kg

     CCROBU    Cancer Chemotherapy Reports, Part 1. 56 (1972),593.
8.    

orl-mus LD50:1238 mg/kg

     NCISP*    National Cancer Institute Screening Program Data Summary, Developmental Therapeutics Program, Bethesda, MD 20205 JAN86 .
9.    

ipr-mus LD50:550 mg/kg

     ARZNAD    Arzneimittel-Forschung. Drug Research. 17 (1967),145.
10.    

orl-rbt LD50:300 mg/kg

     CCROBU    Cancer Chemotherapy Reports, Part 1. 56 (1972),593.

Dibromodulcitol Consensus Reports

NCI Carcinogenesis Bioassay Completed; Results Positive: mouse, rat ( RRCRBU    Recent Results in Cancer Research. 52 (1975),1. ).

Dibromodulcitol Safety Profile

Poison by ingestion. Moderately toxic by intraperitoneal route. Questionable carcinogen with experimental carcinogenic, neoplastigenic, and tumorigenic data. Human mutation data reported. An anti-cancer agent taken orally. When heated to decomposition it emits very toxic fumes of Br−.

Dibromodulcitol Specification

 Dibromodulcitol (CAS NO.10318-26-0) is also named as 1,6-Dibromo-1,6-dideoxy-D-galactitol ; 1,6-Dibromo-1,6-dideoxydulcitol ; 1,6-Dibromo-1,6-dideoxydulcitol (VAN) ; 1,6-Dibromodideoxydulcitol ; 1,6-Dibromodulcitol ; AI3-52708 ; CCRIS 6226 ; DBD ; DBD (alcohol) ; Dibromdulcit ; Dibromdulcitol ; Elobromol ; Mitolactol ; Mitolactolum ; Mitolactolum [INN-Latin] ; NCI-C04795 ; NSC 104800 ; NSC-104800 .

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