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Home > Other Building Blocks > 125637-07-2
125637-07-2 | 1-Penten-3-ol, 2-methyl-, (3R)-
CAS No: 125637-07-2 Catalog No: AG000O8Q MDL No:
Product Description
Catalog Number:
AG000O8Q
Chemical Name:
1-Penten-3-ol, 2-methyl-, (3R)-
CAS Number:
125637-07-2
Molecular Formula:
C6H12O
Molecular Weight:
100.1589
IUPAC Name:
(3R)-2-methylpent-1-en-3-ol
InChI:
InChI=1S/C6H12O/c1-4-6(7)5(2)3/h6-7H,2,4H2,1,3H3/t6-/m1/s1
InChI Key:
DHNPVHJGKASNBQ-ZCFIWIBFSA-N
SMILES:
CC[C@H](C(=C)C)O
Properties
Complexity:
66.6
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Exact Mass:
100.089g/mol
Formal Charge:
0
Heavy Atom Count:
7
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
100.161g/mol
Monoisotopic Mass:
100.089g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
20.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7
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