200,000+ products from a single source!
sales@angenechem.com
Home > Other Building Blocks > 5369-16-4
5369-16-4 | 3-Isopropylaniline
CAS No: 5369-16-4 Catalog No: AG003IXH MDL No:MFCD00092918
Product Description
Catalog Number:
AG003IXH
Chemical Name:
3-Isopropylaniline
CAS Number:
5369-16-4
Molecular Formula:
C9H13N
Molecular Weight:
135.2062
MDL Number:
MFCD00092918
IUPAC Name:
3-propan-2-ylaniline
InChI:
InChI=1S/C9H13N/c1-7(2)8-4-3-5-9(10)6-8/h3-7H,10H2,1-2H3
InChI Key:
XCCNRBCNYGWTQX-UHFFFAOYSA-N
SMILES:
Nc1cccc(c1)C(C)C
Properties
Complexity:
98.9
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
135.105g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
135.21g/mol
Monoisotopic Mass:
135.105g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
26A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.