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Home Other Building Blocks trans-4-Cyanocinnamic acid

trans-4-Cyanocinnamic acid

CAS No.:
16642-94-7
Catalog Number:
AG001WQF
Molecular Formula:
C10H7NO2
Molecular Weight:
173.1681
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
98%
In Stock USA
United States
$30
- +
5g
98%
In Stock USA
United States
$99
- +
10g
98%
In Stock USA
United States
$172
- +
25g
98%
In Stock USA
United States
$327
- +
100g
98%
In Stock USA
United States
$808
- +
Product Description
Catalog Number:
AG001WQF
Chemical Name:
trans-4-Cyanocinnamic acid
CAS Number:
16642-94-7
Molecular Formula:
C10H7NO2
Molecular Weight:
173.1681
MDL Number:
MFCD00016845
IUPAC Name:
(E)-3-(4-cyanophenyl)prop-2-enoic acid
InChI:
InChI=1S/C10H7NO2/c11-7-9-3-1-8(2-4-9)5-6-10(12)13/h1-6H,(H,12,13)/b6-5+
InChI Key:
USVZQKYCNGNRBV-AATRIKPKSA-N
SMILES:
N#Cc1ccc(cc1)/C=C/C(=O)O
NSC Number:
134574
Properties
Complexity:
253  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
1  
Exact Mass:
173.048g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
173.171g/mol
Monoisotopic Mass:
173.048g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
61.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.5  
Literature
Title Journal
Synthesis and SAR studies of 1,4-benzoxazine MenB inhibitors: novel antibacterial agents against Mycobacterium tuberculosis. Bioorganic & medicinal chemistry letters 20101101
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