Home Other Building Blocks 3-(2-METHYL-1,3-DIOXOLAN-2-YL)ANILINE

3-(2-METHYL-1,3-DIOXOLAN-2-YL)ANILINE

CAS No.:
51226-14-3
Catalog Number:
AG00DIIY
Molecular Formula:
C10H13NO2
Molecular Weight:
179.2157
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Product Description
Catalog Number:
AG00DIIY
Chemical Name:
3-(2-METHYL-1,3-DIOXOLAN-2-YL)ANILINE
CAS Number:
51226-14-3
Molecular Formula:
C10H13NO2
Molecular Weight:
179.2157
MDL Number:
MFCD00020904
IUPAC Name:
3-(2-methyl-1,3-dioxolan-2-yl)aniline
InChI:
InChI=1S/C10H13NO2/c1-10(12-5-6-13-10)8-3-2-4-9(11)7-8/h2-4,7H,5-6,11H2,1H3
InChI Key:
ZXMQVZUQYHIOKO-UHFFFAOYSA-N
SMILES:
Nc1cccc(c1)C1(C)OCCO1
NSC Number:
159111
Properties
Complexity:
178  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
179.095g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
179.219g/mol
Monoisotopic Mass:
179.095g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
44.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.8  
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