200,000+ products from a single source!
sales@angenechem.com
831219-90-0 | Butanoic acid, 4-[bis(2-chloroethyl)amino]-3-hydroxy-
CAS No: 831219-90-0 Catalog No: AG005A8S MDL No:
Product Description
Catalog Number:
AG005A8S
Chemical Name:
Butanoic acid, 4-[bis(2-chloroethyl)amino]-3-hydroxy-
CAS Number:
831219-90-0
Molecular Formula:
C8H15Cl2NO3
Molecular Weight:
244.1156
IUPAC Name:
4-[bis(2-chloroethyl)amino]-3-hydroxybutanoic acid
InChI:
InChI=1S/C8H15Cl2NO3/c9-1-3-11(4-2-10)6-7(12)5-8(13)14/h7,12H,1-6H2,(H,13,14)
InChI Key:
RYYBTHPSTAMGEX-UHFFFAOYSA-N
SMILES:
ClCCN(CC(CC(=O)O)O)CCCl
Properties
Complexity:
163
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
243.043g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
244.112g/mol
Monoisotopic Mass:
243.043g/mol
Rotatable Bond Count:
8
Topological Polar Surface Area:
60.8A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
-2
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.