COMPOUND: C19199
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Entry
C19199 Compound
Name
2,2-Bis(bromomethyl)propane-1,3-diol;
Pentaerythritol dibromide
Formula
C5H10Br2O2
Exact mass
259.9048
Mol weight
261.94
Structure
Mol file
KCF file
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CAS:
3296-90-0
PubChem:
124489871
ChEBI:
82294
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KCF data
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ATOM 9
1 C1d C 21.4900 -18.6900
2 C1b C 22.8900 -18.6900
3 C1b C 20.0900 -18.6900
4 C1b C 21.4900 -17.2900
5 C1b C 21.4900 -20.0900
6 O1a O 23.5900 -19.9024
7 X Br 22.7024 -16.5900
8 X Br 20.2776 -20.7900
9 O1a O 19.3900 -17.4776
BOND 8
1 1 2 1
2 1 3 1
3 1 4 1
4 1 5 1
5 2 6 1
6 4 7 1
7 5 8 1
8 3 9 1
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