trans-2,4-Dimethoxycinnamic acid - CAS 16909-09-4

Name: trans-2,4-Dimethoxycinnamic acid
Brand: BOC Sciences
Rating: 5 (1 reviews)

Catalog:	BB012518
Product Name:	trans-2,4-Dimethoxycinnamic acid
CAS:	16909-09-4
Synonyms:	(E)-3-(2,4-dimethoxyphenyl)prop-2-enoic acid

Technical Data

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Computed Properties

IUPAC Name:	(E)-3-(2,4-dimethoxyphenyl)prop-2-enoic acid
Description:	trans-2,4-Dimethoxycinnamic acid (CAS# 16909-09-4) is a useful research chemical.
Molecular Weight:	208.21
Molecular Formula:	C11H12O4
Canonical SMILES:	COC1=CC(=C(C=C1)C=CC(=O)O)OC
InChI:	InChI=1S/C11H12O4/c1-14-9-5-3-8(4-6-11(12)13)10(7-9)15-2/h3-7H,1-2H3,(H,12,13)/b6-4+
InChI Key:	YIKHDPHTFYWYJV-GQCTYLIASA-N
Boiling Point:	384.4 °C at 760 mmHg
Density:	1.203 g/cm³
MDL:	MFCD00016837
LogP:	1.80160

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Related Functional Groups

Carbonyl Compounds

[91125-43-8]C15H22O5S.Na
Sulfophenyl nonanoate sodium salt
[1035840-45-9]C14H16N2O4
1-(5-Methoxy-1,3-benzoxazol-2-yl)piperidine-3-carboxylic acid
[1006443-01-1]C9H6N4O4
1-(5-Nitropyridin-2-yl)-1H-pyrazole-3-carboxylic acid
[253429-30-0]C12H16BrFO3
1-Bromo-2-(2,2-diethoxyethoxy)-4-fluorobenzene
[865774-78-3]C16H21F2NO2
2-(6,8-difluoro-1,2,3,4-tetrahydro-naphthalen-2-ylamino)-pentanoic acid methyl ester
[927676-51-5]C10H6BrNO3
2-(6-Bromo-3-indolyl)-2-oxoacetic Acid

GHS Hazard Statement:	H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]
Precautionary Statement:	P264, P280, P302+P352, P305+P351+P338, P321, P332+P313, P337+P313, and P362
Signal Word:	Warning

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Complexity:	237
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	1
Exact Mass:	208.07355886
Formal Charge:	0
Heavy Atom Count:	15
Hydrogen Bond Acceptor Count:	4
Hydrogen Bond Donor Count:	1
Isotope Atom Count:	0
Monoisotopic Mass:	208.07355886
Rotatable Bond Count:	4
Topological Polar Surface Area:	55.8 Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	1.8