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1429028-35-2

1429028-35-2 | (2S)-1-(1H-imidazol-1-yl)propan-2-ol

CAS No: 1429028-35-2 Catalog No: AG01BXQF MDL No:MFCD26042638

Product Description

Catalog Number:
AG01BXQF
Chemical Name:
(2S)-1-(1H-imidazol-1-yl)propan-2-ol
CAS Number:
1429028-35-2
Molecular Formula:
C6H10N2O
Molecular Weight:
126.1564
MDL Number:
MFCD26042638
IUPAC Name:
1-imidazol-1-ylpropan-2-ol
InChI:
InChI=1S/C6H10N2O/c1-6(9)4-8-3-2-7-5-8/h2-3,5-6,9H,4H2,1H3
InChI Key:
WCDFMPVITAWTGR-UHFFFAOYSA-N
SMILES:
C[C@@H](Cn1cncc1)O
EC Number:
253-668-2

Properties

Complexity:
87.1  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
126.079g/mol
Formal Charge:
0
Heavy Atom Count:
9  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
126.159g/mol
Monoisotopic Mass:
126.079g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
38A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.3  

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