Home Other Building Blocks 2-[3-(but-2-en-1-yloxy)phenyl]acetic acid

2-[3-(but-2-en-1-yloxy)phenyl]acetic acid

CAS No.:
1251405-62-5
Catalog Number:
AG01AUF6
Molecular Formula:
C12H14O3
Molecular Weight:
206.2378
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Product Description
Catalog Number:
AG01AUF6
Chemical Name:
2-[3-(but-2-en-1-yloxy)phenyl]acetic acid
CAS Number:
1251405-62-5
Molecular Formula:
C12H14O3
Molecular Weight:
206.2378
MDL Number:
MFCD14658999
IUPAC Name:
2-(3-but-2-enoxyphenyl)acetic acid
InChI:
InChI=1S/C12H14O3/c1-2-3-7-15-11-6-4-5-10(8-11)9-12(13)14/h2-6,8H,7,9H2,1H3,(H,13,14)
InChI Key:
KYHVQQAMMOHETB-UHFFFAOYSA-N
SMILES:
CC=CCOc1cccc(c1)CC(=O)O
Properties
Complexity:
223  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
206.094g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
206.241g/mol
Monoisotopic Mass:
206.094g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
46.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1  
XLogP3:
2.4  
Properties