200,000+ products from a single source!
sales@angenechem.com
Home > Other Building Blocks > 999-40-6
999-40-6 | NERYL BUTYRATE
CAS No: 999-40-6 Catalog No: AG003VOO MDL No:MFCD00209522
Product Description
Catalog Number:
AG003VOO
Chemical Name:
NERYL BUTYRATE
CAS Number:
999-40-6
Molecular Formula:
C14H24O2
Molecular Weight:
224.3392
MDL Number:
MFCD00209522
IUPAC Name:
[(2Z)-3,7-dimethylocta-2,6-dienyl] butanoate
InChI:
InChI=1S/C14H24O2/c1-5-7-14(15)16-11-10-13(4)9-6-8-12(2)3/h8,10H,5-7,9,11H2,1-4H3/b13-10-
InChI Key:
ZSBOMYJPSRFZAL-RAXLEYEMSA-N
SMILES:
CCCC(=O)OC/C=C(\CCC=C(C)C)/C
EC Number:
213-660-1
UNII:
83580OVF8U
FEMA Number:
2774
Properties
Complexity:
258
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
1
Exact Mass:
224.178g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
224.344g/mol
Monoisotopic Mass:
224.178g/mol
Rotatable Bond Count:
8
Topological Polar Surface Area:
26.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.3
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.