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20924-77-0 | 4-Penten-2-ol, 1-chloro-2-methyl-
CAS No: 20924-77-0 Catalog No: AG002K45 MDL No:
Product Description
Catalog Number:
AG002K45
Chemical Name:
4-Penten-2-ol, 1-chloro-2-methyl-
CAS Number:
20924-77-0
Molecular Formula:
C6H11ClO
Molecular Weight:
134.6039
IUPAC Name:
1-chloro-2-methylpent-4-en-2-ol
InChI:
InChI=1S/C6H11ClO/c1-3-4-6(2,8)5-7/h3,8H,1,4-5H2,2H3
InChI Key:
NGWUGWYUMFFKLE-UHFFFAOYSA-N
SMILES:
CC(CCl)(CC=C)O
Properties
Complexity:
82.6
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
134.05g/mol
Formal Charge:
0
Heavy Atom Count:
8
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
134.603g/mol
Monoisotopic Mass:
134.05g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
20.2A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
1.5
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