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17576-35-1 | 1-Propene, 1,3,3-trimethoxy-
CAS No: 17576-35-1 Catalog No: AG00215X MDL No:MFCD00041903
Product Description
Catalog Number:
AG00215X
Chemical Name:
1-Propene, 1,3,3-trimethoxy-
CAS Number:
17576-35-1
Molecular Formula:
C6H12O3
Molecular Weight:
132.1577
MDL Number:
MFCD00041903
IUPAC Name:
(E)-1,3,3-trimethoxyprop-1-ene
InChI:
InChI=1S/C6H12O3/c1-7-5-4-6(8-2)9-3/h4-6H,1-3H3/b5-4+
InChI Key:
JGVSIZVWGGQMPY-SNAWJCMRSA-N
SMILES:
COC=CC(OC)OC
EC Number:
241-547-7
Properties
Complexity:
76.4
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
1
Exact Mass:
132.079g/mol
Formal Charge:
0
Heavy Atom Count:
9
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
132.159g/mol
Monoisotopic Mass:
132.079g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
27.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.3
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