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128399-92-8 | Pentane, 4-chloro-2,2,3-trimethyl-
CAS No: 128399-92-8 Catalog No: AG000Y23 MDL No:
Product Description
Catalog Number:
AG000Y23
Chemical Name:
Pentane, 4-chloro-2,2,3-trimethyl-
CAS Number:
128399-92-8
Molecular Formula:
C8H17Cl
Molecular Weight:
148.6736
IUPAC Name:
4-chloro-2,2,3-trimethylpentane
InChI:
InChI=1S/C8H17Cl/c1-6(7(2)9)8(3,4)5/h6-7H,1-5H3
InChI Key:
WETDEDULOMQLKK-UHFFFAOYSA-N
SMILES:
CC(C(C(C)(C)C)C)Cl
Properties
Complexity:
81.1
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
148.102g/mol
Formal Charge:
0
Heavy Atom Count:
9
Hydrogen Bond Acceptor Count:
0
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
148.674g/mol
Monoisotopic Mass:
148.102g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
3.8
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