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10522-18-6

10522-18-6 | Methyl undec-2-ynoate

CAS No: 10522-18-6 Catalog No: AG003HYN MDL No:MFCD00065417

Product Description

Catalog Number:
AG003HYN
Chemical Name:
Methyl undec-2-ynoate
CAS Number:
10522-18-6
Molecular Formula:
C12H20O2
Molecular Weight:
196.2860
MDL Number:
MFCD00065417
IUPAC Name:
methyl undec-2-ynoate
InChI:
InChI=1S/C12H20O2/c1-3-4-5-6-7-8-9-10-11-12(13)14-2/h3-9H2,1-2H3
InChI Key:
YPUZOJRRZPRXNV-UHFFFAOYSA-N
SMILES:
CCCCCCCCC#CC(=O)OC
UNII:
5Z9OPD17EP
NSC Number:
289575
FEMA Number:
2751

Properties

Complexity:
207  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
196.146g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
196.29g/mol
Monoisotopic Mass:
196.146g/mol
Rotatable Bond Count:
7  
Topological Polar Surface Area:
26.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.8  

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