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Home Other Building Blocks 4-Isopropoxybenzoic acid

4-Isopropoxybenzoic acid

CAS No.:
13205-46-4
Catalog Number:
AG00104E
Molecular Formula:
C10H12O3
Molecular Weight:
180.2005
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
98%
In Stock USA
United States
$13
- +
5g
98%
In Stock USA
United States
$23
- +
25g
98%
In Stock USA
United States
$68
- +
100g
98%
In Stock USA
United States
$207
- +
500g
98%
In Stock USA
United States
$625
- +
Product Description
Catalog Number:
AG00104E
Chemical Name:
4-Isopropoxybenzoic acid
CAS Number:
13205-46-4
Molecular Formula:
C10H12O3
Molecular Weight:
180.2005
MDL Number:
MFCD00044318
IUPAC Name:
4-propan-2-yloxybenzoic acid
InChI:
InChI=1S/C10H12O3/c1-7(2)13-9-5-3-8(4-6-9)10(11)12/h3-7H,1-2H3,(H,11,12)
InChI Key:
ZVERWTXKKWSSHH-UHFFFAOYSA-N
SMILES:
CC(Oc1ccc(cc1)C(=O)O)C
EC Number:
236-169-4
NSC Number:
16646
Properties
Complexity:
169  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
180.079g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
180.203g/mol
Monoisotopic Mass:
180.079g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
46.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.8  
Literature
Title Journal
Microsphere-based protease assays and screening application for lethal factor and factor Xa. Cytometry. Part A : the journal of the International Society for Analytical Cytology 20060501
Properties