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1464-98-8 | Benzamide, N-2-propyn-1-yl-
CAS No: 1464-98-8 Catalog No: AG001DYZ MDL No:MFCD00544213
Product Description
Catalog Number:
AG001DYZ
Chemical Name:
Benzamide, N-2-propyn-1-yl-
CAS Number:
1464-98-8
Molecular Formula:
C10H9NO
Molecular Weight:
159.1846
MDL Number:
MFCD00544213
IUPAC Name:
N-prop-2-ynylbenzamide
InChI:
InChI=1S/C10H9NO/c1-2-8-11-10(12)9-6-4-3-5-7-9/h1,3-7H,8H2,(H,11,12)
InChI Key:
GWISAVFRFTWMQK-UHFFFAOYSA-N
SMILES:
C#CCNC(=O)c1ccccc1
Properties
Complexity:
195
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
159.068g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
159.188g/mol
Monoisotopic Mass:
159.068g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
29.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.8
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