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17712-36-6

17712-36-6 | 1-Buten-3-yne, 2-chloro- (6CI,7CI,8CI,9CI)

CAS No: 17712-36-6 Catalog No: AG00254M MDL No:

Product Description

Catalog Number:
AG00254M
Chemical Name:
1-Buten-3-yne, 2-chloro- (6CI,7CI,8CI,9CI)
CAS Number:
17712-36-6
Molecular Formula:
C4H3Cl
Molecular Weight:
86.5196
IUPAC Name:
2-chlorobut-1-en-3-yne
InChI:
InChI=1S/C4H3Cl/c1-3-4(2)5/h1H,2H2
InChI Key:
KRSMTQBJRPTXRB-UHFFFAOYSA-N
SMILES:
ClC(=C)C#C

Properties

Complexity:
83.1  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
85.992g/mol
Formal Charge:
0
Heavy Atom Count:
5  
Hydrogen Bond Acceptor Count:
0
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
86.518g/mol
Monoisotopic Mass:
85.992g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7  

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