KEGG   COMPOUND: C14688Help
Entry
C14688                      Compound                               

Name
Bis(2-chloroethyl)ether;
2,2'-Dichlorethyl ether;
1,5-Dichloro-3-oxapentane
Formula
C4H8Cl2O
Exact mass
141.9952
Mol weight
143.0117
Structure
Mol fileKCF fileDB search
Brite
Carcinogens [BR:br08008]
 Group 3: Not classifiable as to its carcinogenicity to humans
  Compounds
   C14688  Bis(2-chloroethyl)ether
BRITE hierarchy
Other DBs
CAS: 111-44-4
PubChem: 17395687
ChEBI: 34573
ChEMBL: CHEMBL1613350
NIKKAJI: J2.455D
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KCF data Show

ATOM        7
            1   X   Cl   15.4700  -20.5800
            2   C1b C    16.6824  -21.2800
            3   C1b C    17.8779  -20.5896
            4   O2a O    19.0653  -21.2751
            5   C1b C    20.2565  -20.5871
            6   C1b C    21.4460  -21.2738
            7   X   Cl   22.6361  -20.5865
BOND        6
            1     1   2 1
            2     2   3 1
            3     3   4 1
            4     4   5 1
            5     5   6 1
            6     6   7 1

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