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Details

Stereochemistry ACHIRAL
Molecular Formula C5H12O
Molecular Weight 88.1482
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of Amylene hydrate

SMILES

CCC(C)(C)O

InChI

InChIKey=MSXVEPNJUHWQHW-UHFFFAOYSA-N
InChI=1S/C5H12O/c1-4-5(2,3)6/h6H,4H2,1-3H3

HIDE SMILES / InChI
Molecular Formula C5H12O
Molecular Weight 88.1482
Charge 0
Count
MOL RATIO 1 MOL RATIO (average)
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

Unknown
149,124

PubMed

Patents

04948887
5
05187311
2
05206312
2
05354869
4
05468722
2
05658769
2
05756759
2
05849926
2
05977130
3
06720315
2
06805978
2
06953806
2
07001909
2
07026321
4
07205300
2
07259262
2
07595320
2
07632973
3
07696357
4
07915404
2
08138176
2
08188079
2
08344008
2
08367658
33
08507676
2
08846855
2
20090065766
2
20090065878
2
20120295842
2
Substance Class Chemical
Record UNII
69C393R11Z
Record Status Validated (UNII)
Record Version
NIH
NCATS
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