Trans-Styrylacetic acid

CAT: 0024-sc-229542Size: 1 gDry Ice: NoHazardous: No

1 / 1

CAT#:0024-sc-229542Size:1 g

Selected

24/48H Stock Items & 2 to 6 Weeks non Stock Items.

Quick Request Actions

CAS Number

1914-58-5

Chemical Information

3-Butenoic acid, 4-phenyl-, (3E)-

(E)-4-phenylbut-3-enoic acid has been reported in Streptomyces albidoflavus and Streptomyces koyangensis with data available.

CAS Number	1914-58-5
PubChem CID	5370625
IUPAC Name	(E)-4-phenylbut-3-enoic acid
Molecular Formula	C10H10O2
Molecular Weight	162.18
XLogP	2.3
Topological Polar Surface Area	37.3
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	3
Heavy Atom Count	12
Formal Charge	0
Complexity	167

SMILES

C1=CC=C(C=C1)/C=C/CC(=O)O

InChI

InChI=1S/C10H10O2/c11-10(12)8-4-7-9-5-2-1-3-6-9/h1-7H,8H2,(H,11,12)/b7-4+

InChIKey

PSCXFXNEYIHJST-QPJJXVBHSA-N

Chemical Structure

2D Structure

CAS: 1914-58-5

CID: 5370625

Formula: C10H10O2

MW: 162.18

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	162.18
XLogP3	2.3
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	3
Exact Mass	162.068079557
Monoisotopic Mass	162.068079557
Topological Polar Surface Area	37.3 Å²
Heavy Atom Count	12
Formal Charge	0
Complexity	167
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	1
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes

Catalog	Name
sc-220317	(trans, trans) -Abscisic Acid
sc-251287A	Trans, trans-Muconic acid
sc-251287	Trans, trans-Muconic acid
sc-220318	Trans, trans-Muconic Acid-d4
sc-255679	Trans-Aconitic acid
sc-216002	Trans-Vaccenic acid
sc-251283A	Trans-Cinnamic acid
sc-506105	Trans-Sinapic acid
sc-482561	Trans-Methylcyclopropanecarboxylic Acid
sc-251283B	Trans-Cinnamic acid

Catalog	Name
289531-01	Trans-Styrylacetic acid
242450-01	Trans-Styrylacetic acid 99+% (HPLC)
017901	Trans, trans-Muconic Acid
TRC-A110025-50MG	(+)-trans,trans-Abscisic Acid
GTR19157345-01	Trans-trans-Muconic acid
B7915-500	trans-trans Muconic acid
TRC-M791001-100G	trans,trans-Muconic Acid