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116421-39-7 | Cyclopropaneacetic acid, 2,2-dimethyl-3-propyl-, cis- (9CI)
CAS No: 116421-39-7 Catalog No: AG000CGQ MDL No:
Product Description
Catalog Number:
AG000CGQ
Chemical Name:
Cyclopropaneacetic acid, 2,2-dimethyl-3-propyl-, cis- (9CI)
CAS Number:
116421-39-7
Molecular Formula:
C10H18O2
Molecular Weight:
170.2487
IUPAC Name:
2-(2,2-dimethyl-3-propylcyclopropyl)acetic acid
InChI:
InChI=1S/C10H18O2/c1-4-5-7-8(6-9(11)12)10(7,2)3/h7-8H,4-6H2,1-3H3,(H,11,12)
InChI Key:
YYRFQBQTAKHHFF-UHFFFAOYSA-N
SMILES:
CCC[C@@H]1[C@@H](C1(C)C)CC(=O)O
Properties
Complexity:
184
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
170.131g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
170.252g/mol
Monoisotopic Mass:
170.131g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
37.3A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
2.8
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