3- (3-Chlorophenyl) -1-propene

CAT: 0024-sc-322203Size: 5 gDry Ice: NoHazardous: No

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CAT#:0024-sc-322203Size:5 g

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CAS Number

3840-17-3

Chemical Information

1-Allyl-3-chlorobenzene

CAS Number	3840-17-3
PubChem CID	2757844
IUPAC Name	1-chloro-3-prop-2-enylbenzene
Molecular Formula	C9H9Cl
Molecular Weight	152.62
XLogP	4
Topological Polar Surface Area	0
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	0
Rotatable Bond Count	2
Heavy Atom Count	10
Formal Charge	0
Complexity	109

SMILES

C=CCC1=CC(=CC=C1)Cl

InChI

InChI=1S/C9H9Cl/c1-2-4-8-5-3-6-9(10)7-8/h2-3,5-7H,1,4H2

InChIKey

UYLHDGQKBPNWQI-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 3840-17-3

CID: 2757844

Formula: C9H9Cl

MW: 152.62

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	152.62
XLogP3	4
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	0
Rotatable Bond Count	2
Exact Mass	152.0392780
Monoisotopic Mass	152.0392780
Topological Polar Surface Area	0 Å²
Heavy Atom Count	10
Formal Charge	0
Complexity	109
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes

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