Home Other Building Blocks (5-BROMOOXAZOL-2-YL)METHANOL

(5-BROMOOXAZOL-2-YL)METHANOL

CAS No.:
1454907-14-2
Catalog Number:
AG01DKUW
Molecular Formula:
C4H4BrNO2
Molecular Weight:
177.9841
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Product Description
Catalog Number:
AG01DKUW
Chemical Name:
(5-BROMOOXAZOL-2-YL)METHANOL
CAS Number:
1454907-14-2
Molecular Formula:
C4H4BrNO2
Molecular Weight:
177.9841
MDL Number:
MFCD27991410
IUPAC Name:
(5-bromo-1,3-oxazol-2-yl)methanol
InChI:
InChI=1S/C4H4BrNO2/c5-3-1-6-4(2-7)8-3/h1,7H,2H2
InChI Key:
NRCNATHPEVHILM-UHFFFAOYSA-N
SMILES:
OCc1ncc(o1)Br
Properties
Complexity:
80.4  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
176.943g/mol
Formal Charge:
0
Heavy Atom Count:
8  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
177.985g/mol
Monoisotopic Mass:
176.943g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
46.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.5  
Properties