1-PHENYL-1-PROPYNE

Details

Stereochemistry	ACHIRAL
Molecular Formula	C9H8
Molecular Weight	116.1598
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

SMILES

CC#CC1=CC=CC=C1

InChI

InChIKey=GHUURDQYRGVEHX-UHFFFAOYSA-N

InChI=1S/C9H8/c1-2-6-9-7-4-3-5-8-9/h3-5,7-8H,1H3

HIDE SMILES / InChI

Molecular Formula	C9H8
Molecular Weight	116.1598
Charge	0
Count	MOL RATIO 1 MOL RATIO (average)

Stereochemistry	ACHIRAL
Additional Stereochemistry	No
Defined Stereocenters	0 / 0
E/Z Centers	0
Optical Activity	NONE

Approval Year

PubMed

Show entries

Title	Date	PubMed
Cp*(2)TiMe(2): an improved catalyst for the intermolecular addition of n-alkyl- and benzylamines to alkynes.	2002 Mar 22	11895418
Regiochemical variation in the electrophilic addition of HBr to 1-phenylprop-1-yne.	2003 Jun 21	12945905
Photoionization of three isomers of the C9H7 radical.	2010 Apr 15	19813740
Ab initio/RRKM-ME study on the mechanism and kinetics of the reaction of phenyl radical with 1,2-butadiene.	2010 Jul 29	20593856

Showing 1 to 4 of 4 entries

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Patents

Substance Class	Chemical
Record UNII	448376BFQC
Record Status	`Validated (UNII)`
Record Version

Show entries

Name

Type

Language

1-PHENYL-1-PROPYNE

Systematic Name

English

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Show entries

Code System

Code

Type

Description

MESH

C043843

PRIMARY

EPA CompTox

DTXSID10217667

PRIMARY

FDA UNII

448376BFQC

PRIMARY

CAS

673-32-5

PRIMARY

ECHA (EC/EINECS)

211-607-7

PRIMARY

Showing 1 to 5 of 6 entries

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