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139633-98-0 | Benzene, (1-ethynylcyclopropyl)-
CAS No: 139633-98-0 Catalog No: AG001BFV MDL No:MFCD11109424
Product Description
Catalog Number:
AG001BFV
Chemical Name:
Benzene, (1-ethynylcyclopropyl)-
CAS Number:
139633-98-0
Molecular Formula:
C11H10
Molecular Weight:
142.1971
MDL Number:
MFCD11109424
IUPAC Name:
(1-ethynylcyclopropyl)benzene
InChI:
InChI=1S/C11H10/c1-2-11(8-9-11)10-6-4-3-5-7-10/h1,3-7H,8-9H2
InChI Key:
JZMJNHMUPFGYFK-UHFFFAOYSA-N
SMILES:
C#CC1(CC1)c1ccccc1
Properties
Complexity:
183
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
142.078g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
0
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
142.201g/mol
Monoisotopic Mass:
142.078g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.1
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