3-Allyl salicylaldehyde

CAT: 0926-FA17302-01Size: 1 gDry Ice: NoHazardous: No

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CAT#:0926-FA17302-01Size:1 g

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CAS Number

24019-66-7

Synonyms

3-Allyl-2-hydroxybenzaldehyde;2-Hydroxy-3- (2-propen-1-yl) benzaldehyde

MDL Number

MFCD27977641

Smiles

C=CCC1=C (C (=CC=C1) C=O) O

Molecular Formula

C10H10O2

Molecular Weight

162.19 g/mol

Controlled

Chemical Information

3-Allylsalicylaldehyde

CAS Number	24019-66-7
PubChem CID	141062
IUPAC Name	2-hydroxy-3-prop-2-enylbenzaldehyde
Molecular Formula	C10H10O2
Molecular Weight	162.18
XLogP	2.7
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	165

SMILES

C=CCC1=C(C(=CC=C1)C=O)O

InChI

InChI=1S/C10H10O2/c1-2-4-8-5-3-6-9(7-11)10(8)12/h2-3,5-7,12H,1,4H2

InChIKey

INLWEXRRMUMHKB-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 24019-66-7

CID: 141062

Formula: C10H10O2

MW: 162.18

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	162.18
XLogP3	2.7
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	165
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

Catalog	Name
FS34067-01	Salicylaldehyde
FS03677-01	Salicylaldehyde azine
FS30260-01	Salicylaldehyde phenylhydrazone
FT11116-01	5- (Trifluoromethoxy) salicylaldehyde
FD38639-01	4- (N, N-Diethylamino) salicylaldehyde
DAA76655-01	4-Allyl-3-thiosemicarbazide
RBA05288-01	3-Allyl-4-hydroxybenzaldehyde
SLB95673-01	1-Allyl-3-methylimidazolium dicyanamide
FA175609-01	1-Allyl-3-methylimidazolium chloride
QCA03907-01	1-Allyl-3-methyl-imidazoliumiodid

Catalog	Name
TRC-A575000-5G	3-Allyl Salicylaldehyde
MBS6098861-01	3-Allyl Salicylaldehyde (3-Allyl-2-Hydroxybenzaldehyde)
sc-275862	3- (Trifluoromethoxy) salicylaldehyde
GK4505-500g	Salicylaldehyde
CS-T-96016	Salicylaldehyde-13C6
289015-01	Salicylaldehyde azine