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6627-94-7 | Phenol,4-chloro-2,3,5-trimethyl-
CAS No: 6627-94-7 Catalog No: AG01FOS0 MDL No:
Product Description
Catalog Number:
AG01FOS0
Chemical Name:
Phenol,4-chloro-2,3,5-trimethyl-
CAS Number:
6627-94-7
IUPAC Name:
4-chloro-2,3,5-trimethylphenol
InChI:
InChI=1S/C9H11ClO/c1-5-4-8(11)6(2)7(3)9(5)10/h4,11H,1-3H3
InChI Key:
LXBONPACIOPBAZ-UHFFFAOYSA-N
NSC Number:
60264
Properties
Complexity:
138
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
170.05g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
170.636g/mol
Monoisotopic Mass:
170.05g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
20.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.7
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