Home Aldehydes 4-(4-Hydroxybut-1-yn-1-yl)benzaldehyde

4-(4-Hydroxybut-1-yn-1-yl)benzaldehyde

CAS No.:
544707-13-3
Catalog Number:
AG00DAV0
Molecular Formula:
C11H10O2
Molecular Weight:
174.1959
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
95%
In Stock USA
United States
$168
- +
5g
95%
In Stock USA
United States
$444
- +
Product Description
Catalog Number:
AG00DAV0
Chemical Name:
4-(4-Hydroxybut-1-yn-1-yl)benzaldehyde
CAS Number:
544707-13-3
Molecular Formula:
C11H10O2
Molecular Weight:
174.1959
MDL Number:
MFCD03406287
IUPAC Name:
4-(4-hydroxybut-1-ynyl)benzaldehyde
InChI:
InChI=1S/C11H10O2/c12-8-2-1-3-10-4-6-11(9-13)7-5-10/h4-7,9,12H,2,8H2
InChI Key:
JNMGWHGSRGUHJY-UHFFFAOYSA-N
SMILES:
OCCC#Cc1ccc(cc1)C=O
Properties
Complexity:
213  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
174.068g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
174.199g/mol
Monoisotopic Mass:
174.068g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
37.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.4  
Properties