200,000+ products from a single source!
sales@angenechem.com
Home > Other Building Blocks > 132885-49-5
132885-49-5 | Butanedioic acid, (1-methylpropylidene)-, (Z)- (9CI)
CAS No: 132885-49-5 Catalog No: AG0011BT MDL No:
Product Description
Catalog Number:
AG0011BT
Chemical Name:
Butanedioic acid, (1-methylpropylidene)-, (Z)- (9CI)
CAS Number:
132885-49-5
Molecular Formula:
C8H12O4
Molecular Weight:
172.1785
IUPAC Name:
2-butan-2-ylidenebutanedioic acid
InChI:
InChI=1S/C8H12O4/c1-3-5(2)6(8(11)12)4-7(9)10/h3-4H2,1-2H3,(H,9,10)(H,11,12)
InChI Key:
TVBUURYOYAXGMP-UHFFFAOYSA-N
SMILES:
CC/C(=C(\C(=O)O)/CC(=O)O)/C
Properties
Complexity:
227
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
172.074g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
172.18g/mol
Monoisotopic Mass:
172.074g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
74.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1
XLogP3:
1.1
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.