Cas no 286013-06-7 (Propane-2-13C,1,3-dibromo- (9CI))
286013-06-7 structure
Product Name:Propane-2-13C,1,3-dibromo- (9CI)
Propane-2-13C,1,3-dibromo- (9CI) Chemical and Physical Properties
Names and Identifiers
-
- Propane-2-13C,1,3-dibromo- (9CI)
- 1,3-Dibromopropane-2-13C
- NSC 62663
- 286013-06-7
- J-802013
- Trimethylene bromide
- DTXSID1021902
- D77913
- WLN: E3E
- EN300-19283
- CAS-109-64-8
- AMY25527
- 1, 3-dibromopropane
- TRIMETHYLENE BROMIDE [MI]
- J-503888
- CCRIS 6711
- EINECS 203-690-3
- Trimethylene dibromide
- alpha,gamma-Dibromopropane
- Br(CH2)3Br
- BP-31190
- 1,3-dibromo -propane
- 1,3-dibromo- propane
- HSDB 7408
- SCHEMBL2175
- NS00023526
- 1,3dibromopropane
- 1,3-DIBROMOPROPANE
- YQR3048IX9
- 1.3-dibromopropane
- D0202
- AI3-28592
- 1,3-Dibromopropane, Vetec(TM) reagent grade, 97.5%
- NSC-62663
- 1,3 dibromopropane
- NCGC00260264-01
- 1,3-Dibromopropane, ReagentPlus(R), 99%
- DTXCID701902
- Propane, 1,3-dibromo-
- AKOS000118758
- .omega.,.omega.'-Dibromopropane
- 1,3-dibromo-propane
- 1,3-DIBROMOPROPANE [HSDB]
- F0001-0197
- MFCD00000255
- Q408240
- C3H6Br2
- .alpha.,.gamma.-Dibromopropane
- CH2BrCH2CH2Br
- 1,3-di-bromopropane
- UNII-YQR3048IX9
- Dibromo-1,3 propane
- 1,3-dibromopropan
- FT-0606630
- 1,3- dibromopropane
- NSC62663
- Dibromopropane, 1,3-
- 1,3-dibrompropane
- 1,3-dibromo propane
- InChI=1/C3H6Br2/c4-2-1-3-5/h1-3H
- A802067
- Tox21_202716
- 109-64-8
- CS-W020641
-
- Inchi： 1S/C3H6Br2/c4-2-1-3-5/h1-3H2
- InChI Key： VEFLKXRACNJHOV-UHFFFAOYSA-N
- SMILES： BrCCCBr
Computed Properties
- Exact Mass: 201.88158g/mol
- Monoisotopic Mass: 199.88363g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 0
- Heavy Atom Count: 5
- Rotatable Bond Count: 2
- Complexity: 12.4
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 2.4
- Topological Polar Surface Area: 0?2
Experimental Properties
- Density: 1.999?g/mL?at 25?°C
- Melting Point: -34?°C(lit.)
- Boiling Point: 167?°C(lit.)
- Flash Point: 56?°C
- LogP: log Kow = 2.37
Propane-2-13C,1,3-dibromo- (9CI) Security Information
- Hazardous Material transportation number：UN 1993 3/PG 3
- Hazard Category Code： 10-22-38-51/53
- Safety Instruction： 16-26-36-61
- RTECS：TX8575000
-
Hazardous Material Identification：
Propane-2-13C,1,3-dibromo- (9CI) Related Literature
-
Bidou Wang,Xifeng Chen Analyst, 2014,139, 5695-5699
-
Xiang Liu,Qian Sun,A. B. Djuri?i?,Maohai Xie,Baohu Dai,Jinyao Tang,Charles Surya,Changzhong Liao,Kaimin Shih RSC Adv., 2015,5, 100783-100789
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