Home Nitriles 2-(3-Hydroxyprop-1-ynyl)benzonitrile

2-(3-Hydroxyprop-1-ynyl)benzonitrile

CAS No.:
210884-99-4
Catalog Number:
AG002L1L
Molecular Formula:
C10H7NO
Molecular Weight:
157.1687
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
95%
In Stock USA
United States
$129
- +
5g
95%
In Stock USA
United States
$316
- +
Product Description
Catalog Number:
AG002L1L
Chemical Name:
2-(3-Hydroxyprop-1-ynyl)benzonitrile
CAS Number:
210884-99-4
Molecular Formula:
C10H7NO
Molecular Weight:
157.1687
MDL Number:
MFCD04039091
IUPAC Name:
2-(3-hydroxyprop-1-ynyl)benzonitrile
InChI:
InChI=1S/C10H7NO/c11-8-10-5-2-1-4-9(10)6-3-7-12/h1-2,4-5,12H,7H2
InChI Key:
ABSXJTJGIGJBOE-UHFFFAOYSA-N
SMILES:
OCC#Cc1ccccc1C#N
Properties
Complexity:
249  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
157.053g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
157.172g/mol
Monoisotopic Mass:
157.053g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
44A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.4  
Properties