Home Other Building Blocks methyl 2-methylpent-4-ynoate

methyl 2-methylpent-4-ynoate

CAS No.:
1481509-00-5
Catalog Number:
AG01B1PX
Molecular Formula:
C7H10O2
Molecular Weight:
126.1531
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Product Description
Catalog Number:
AG01B1PX
Chemical Name:
methyl 2-methylpent-4-ynoate
CAS Number:
1481509-00-5
Molecular Formula:
C7H10O2
Molecular Weight:
126.1531
MDL Number:
MFCD22023857
IUPAC Name:
methyl 2-methylpent-4-ynoate
InChI:
InChI=1S/C7H10O2/c1-4-5-6(2)7(8)9-3/h1,6H,5H2,2-3H3
InChI Key:
OLKZKTPKVOMJGQ-UHFFFAOYSA-N
SMILES:
CC(C(=O)OC)CC#C
Properties
Complexity:
140  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
126.068g/mol
Formal Charge:
0
Heavy Atom Count:
9  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
126.155g/mol
Monoisotopic Mass:
126.068g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
26.3A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
1.2  
Properties