Home Other Building Blocks Prop-2-yn-1-yl butylcarbamate

Prop-2-yn-1-yl butylcarbamate

CAS No.:
76114-73-3
Catalog Number:
AG005RTM
Molecular Formula:
C8H13NO2
Molecular Weight:
155.1943
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Product Description
Catalog Number:
AG005RTM
Chemical Name:
Prop-2-yn-1-yl butylcarbamate
CAS Number:
76114-73-3
Molecular Formula:
C8H13NO2
Molecular Weight:
155.1943
MDL Number:
MFCD06411065
IUPAC Name:
prop-2-ynyl N-butylcarbamate
InChI:
InChI=1S/C8H13NO2/c1-3-5-6-9-8(10)11-7-4-2/h2H,3,5-7H2,1H3,(H,9,10)
InChI Key:
JTDBXHIIVZZXDH-UHFFFAOYSA-N
SMILES:
CCCCNC(=O)OCC#C
EC Number:
616-291-8
Properties
Complexity:
157  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
155.095g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
155.197g/mol
Monoisotopic Mass:
155.095g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
38.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.3  
Properties