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Compound: 5546
Plants: 312
References: 992
Visitors: 57
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1-amino-2-propanol
ScientificNameLabel
1-amino-2-propanol
PHCD compound ID :
5620
Chemical Names :
1-amino-2-propanol
Molecular Formula :
C3H9N1O1
Molecular Weight :
75.068414
More Details :
Names & Synonyms:
1-aminopropan-2-ol , 1-amino-2-propanol , 1-azanylpropan-2-ol
Smiles:
C[C@H](CN)O
InChi :
InChI=1S/C3H9NO/c1-3(5)2-4/h3,5H,2,4H2,1H3/t3-/m1/s1
InChi Key :
InChIKey=HXKKHQJGJAFBHI-GSVOUGTGSA-N
PubChem ID :
4
Rotatable bond count :
1
Rule of five :
0
Hydrogen bond acceptor count :
2
Ionization potential :
9.593436
Hydrogen bond donor count :
2
Electric dipole moment :
2.753
XLogP :
-0.815
VDW volume :
80.231399
Molecular weight :
75.068414
HOMO-LUMO gap :
12.303000
Herb list :
Cotton thistle, Scotch thistle - Onopordon acanthium - خار پنبه، خار پیرزن
Refrences & Litretures:
947. Journal:'Plants' Year:'2019' Volume:'8' Page:'40' DOI:'10.3390/plants8020040' Title:'Traditional Medicine Plant, Onopordum acanthium L. (Asteraceae): Chemical Composition and Pharmacological Research'
Copyright © 2017, Chemistry and Chemical Engineering Research Center of Iran. All rights reserved.
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