COMPOUND: C14399
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Entry
C14399 Compound
Name
1,3-Dichloro-2-propanol
Formula
C3H6Cl2O
Exact mass
127.9796
Mol weight
128.98
Structure
Mol file
KCF file
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CAS:
96-23-1
PubChem:
17395399
ChEBI:
18917
NIKKAJI:
J3.964K
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KCF data
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ATOM 6
1 C1b C 27.6915 -15.9046
2 C1c C 28.9124 -16.6095
3 X Cl 26.4706 -16.6095
4 C1b C 30.1162 -15.9142
5 X Cl 31.3119 -16.6045
6 O1a O 28.9125 -18.0191
BOND 5
1 1 2 1
2 1 3 1
3 2 4 1
4 4 5 1
5 2 6 1
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