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90530-04-4 | BICYCLO [2.2.1] HEPTANE, 2-ETHYLIDENE-6-ISOPROPOXY
CAS No: 90530-04-4 Catalog No: AG00GV9T MDL No:
Product Description
Catalog Number:
AG00GV9T
Chemical Name:
BICYCLO [2.2.1] HEPTANE, 2-ETHYLIDENE-6-ISOPROPOXY
CAS Number:
90530-04-4
IUPAC Name:
(1S,2E,4R)-2-ethylidene-6-propan-2-yloxybicyclo[2.2.1]heptane
InChI:
InChI=1S/C12H20O/c1-4-10-5-9-6-11(10)12(7-9)13-8(2)3/h4,8-9,11-12H,5-7H2,1-3H3/b10-4+/t9-,11-,12?/m0/s1
InChI Key:
DFAHIMHECXLSIS-BMKPUPTLSA-N
EC Number:
292-041-8
Properties
Complexity:
217
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
2
Defined Bond Stereocenter Count:
1
Exact Mass:
180.151g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
180.291g/mol
Monoisotopic Mass:
180.151g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
9.2A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
2.5
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