Home Other Building Blocks 1-methoxy-3-(3-methylbut-2-en-1-yl)benzene

1-methoxy-3-(3-methylbut-2-en-1-yl)benzene

CAS No.:
18272-91-8
Catalog Number:
AG01B270
Molecular Formula:
C12H16O
Molecular Weight:
176.2548
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Product Description
Catalog Number:
AG01B270
Chemical Name:
1-methoxy-3-(3-methylbut-2-en-1-yl)benzene
CAS Number:
18272-91-8
Molecular Formula:
C12H16O
Molecular Weight:
176.2548
MDL Number:
MFCD29991566
IUPAC Name:
1-methoxy-3-(3-methylbut-2-enyl)benzene
InChI:
InChI=1S/C12H16O/c1-10(2)7-8-11-5-4-6-12(9-11)13-3/h4-7,9H,8H2,1-3H3
InChI Key:
YYOGXZOAGZPGDB-UHFFFAOYSA-N
SMILES:
COc1cccc(c1)CC=C(C)C
Properties
Complexity:
168  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
176.12g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
176.259g/mol
Monoisotopic Mass:
176.12g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
9.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.2  
Properties