200,000+ products from a single source!
sales@angenechem.com
Home > Other Building Blocks > 100543-40-6
100543-40-6 | Phosphonic acid, (1-methylpropyl)-, dibutyl ester (9CI)
CAS No: 100543-40-6 Catalog No: AG0002A5 MDL No:
Product Description
Catalog Number:
AG0002A5
Chemical Name:
Phosphonic acid, (1-methylpropyl)-, dibutyl ester (9CI)
CAS Number:
100543-40-6
Molecular Formula:
C12H27O3P
Molecular Weight:
250.3147
IUPAC Name:
1-[butan-2-yl(butoxy)phosphoryl]oxybutane
InChI:
InChI=1S/C12H27O3P/c1-5-8-10-14-16(13,12(4)7-3)15-11-9-6-2/h12H,5-11H2,1-4H3
InChI Key:
KBOOGSYKNKPHCZ-UHFFFAOYSA-N
SMILES:
CCCCOP(=O)(C(CC)C)OCCCC
Properties
Complexity:
192
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
250.17g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
250.319g/mol
Monoisotopic Mass:
250.17g/mol
Rotatable Bond Count:
10
Topological Polar Surface Area:
35.5A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
3.3
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.