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7035-03-2,MFCD00001902
Catalog No.:AA003HHP
7035-03-2 | 2-Methoxyphenylacetonitrile
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25g
>98.0%(GC)
1 week  
$77.00
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  • Technical Information
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Technical Information
Catalog Number:
AA003HHP
Chemical Name:
2-Methoxyphenylacetonitrile
CAS Number:
7035-03-2
Molecular Formula:
C9H9NO
Molecular Weight:
147.1739
MDL Number:
MFCD00001902
IUPAC Name:
2-(2-methoxyphenyl)acetonitrile
InChI:
InChI=1S/C9H9NO/c1-11-9-5-3-2-4-8(9)6-7-10/h2-5H,6H2,1H3
InChI Key:
DWJKILXTMUGXOU-UHFFFAOYSA-N
SMILES:
N#CCc1ccccc1OC
EC Number:
230-314-5
Properties
Computed Properties
 
Complexity:
158  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
147.068g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
147.177g/mol
Monoisotopic Mass:
147.068g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
33A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7  

Synonyms
 
2-Methoxyphenylacetonitrile 
(2-Methoxyphenyl)acetonitrile 
MFCD00001902 
2-(2-methoxyphenyl)ethanenitrile 
2-methoxybenzylcyanid 
o-methoxybenzylcyanide 
2-methoxybenzylcyanide 
2-methoxy benzylcyanide 
ACMC-1BF0H 
2-Methoxybenzeneacetonitrile 
AC1Q45CH 
SCHEMBL198463 
7035-03-2 
AC1L31G4 
AC1Q4S46 
CTK3J3326 
DTXSID40220629 
2-Methoxyphenylacetonitrile, 98% 
ZINC406907 
ALBB-023714 
EINECS 230-314-5 
ANW-14080 
BBL019365 
2-Methoxybenzyl cyanide 
SBB065125 
STL164351 
AKOS000119408 
AS01652 
MCULE-4272840207 
VZ24883 
K796 
ZB013674 
AB0014384 
DB-055406 
2-(2-methoxyphenyl)acetonitrile 
RT-001412 
A9281 
CS-0065824 
FT-0612863 
M0855 
R1025 
ST45026905 
AZ0001-0336 
AK-087/40365554 
I01-7071 
Benzeneacetonitrile, 2-methoxy- 
W-104557 
F0001-1821 
InChI=1/C9H9NO/c1-11-9-5-3-2-4-8(9)6-7-10/h2-5H,6H2,1H 
(Methoxyphenyl)acetonitrile 
C9H9NO 
KST-1A0306 
CID81496 
AR-1A7707 
ZINC00406907 
5211-62-1 
o-methoxyphenylacetonitrile 
7435-12-3 
7035-53-2 
o-Methoxybenzyl cyanide 
(o-Methoxyphenyl)acetonitrile 
DWJKILXTMUGXOU-UHFFFAOYSA-N 
Literature
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