Home Other Building Blocks ETHYL 2,2-DIMETHYLPENT-4-YNOATE

ETHYL 2,2-DIMETHYLPENT-4-YNOATE

CAS No.:
107540-02-3
Catalog Number:
AG01DUYB
Molecular Formula:
C9H14O2
Molecular Weight:
154.2063
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Product Description
Catalog Number:
AG01DUYB
Chemical Name:
ETHYL 2,2-DIMETHYLPENT-4-YNOATE
CAS Number:
107540-02-3
Molecular Formula:
C9H14O2
Molecular Weight:
154.2063
MDL Number:
MFCD22023966
IUPAC Name:
ethyl 2,2-dimethylpent-4-ynoate
InChI:
InChI=1S/C9H14O2/c1-5-7-9(3,4)8(10)11-6-2/h1H,6-7H2,2-4H3
InChI Key:
JVIMTZKDPIEVNB-UHFFFAOYSA-N
SMILES:
CCOC(=O)C(CC#C)(C)C
Properties
Complexity:
183  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
154.099g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
154.209g/mol
Monoisotopic Mass:
154.099g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
26.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.9  
Properties