200,000+ products from a single source!
sales@angenechem.com
89074-18-0 | Benzaldehyde, 4-(butylamino)-
CAS No: 89074-18-0 Catalog No: AG0087DO MDL No:
Product Description
Catalog Number:
AG0087DO
Chemical Name:
Benzaldehyde, 4-(butylamino)-
CAS Number:
89074-18-0
Molecular Formula:
C11H15NO
Molecular Weight:
177.2429
IUPAC Name:
4-(butylamino)benzaldehyde
InChI:
InChI=1S/C11H15NO/c1-2-3-8-12-11-6-4-10(9-13)5-7-11/h4-7,9,12H,2-3,8H2,1H3
InChI Key:
ZNZMSBIJDNXMOP-UHFFFAOYSA-N
SMILES:
CCCCNc1ccc(cc1)C=O
Properties
Complexity:
139
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
177.115g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
177.247g/mol
Monoisotopic Mass:
177.115g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
29.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.6
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.