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83320-37-0 | Benzene, (3-methoxy-1-butenyl)-
CAS No: 83320-37-0 Catalog No: AG004T0I MDL No:
Product Description
Catalog Number:
AG004T0I
Chemical Name:
Benzene, (3-methoxy-1-butenyl)-
CAS Number:
83320-37-0
Molecular Formula:
C11H14O
Molecular Weight:
162.2283
IUPAC Name:
3-methoxybut-1-enylbenzene
InChI:
InChI=1S/C11H14O/c1-10(12-2)8-9-11-6-4-3-5-7-11/h3-10H,1-2H3
InChI Key:
FEQIPECZADYPJN-UHFFFAOYSA-N
SMILES:
COC(C=Cc1ccccc1)C
Properties
Complexity:
134
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
162.104g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
162.232g/mol
Monoisotopic Mass:
162.104g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
9.2A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
1
XLogP3:
2.6
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