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| CAS Number | 2316-26-9 |
| Catalog Number | AG002MEY(AGN-PC-07A1XM) |
| Chemical Name | 2-Propenoic acid, 3-(3,4-dimethoxyphenyl)- |
| IUPAC Name | (E)-3-(3,4-dimethoxyphenyl)prop-2-enoic acid |
| InChI | InChI=1S/C11H12O4/c1-14-9-5-3-8(4-6-11(12)13)7-10(9)15-2/h3-7H,1-2H3,(H,12,13)/b6-4+ |
| InChI Key | HJBWJAPEBGSQPR-GQCTYLIASA-N |
| MDL Number | MFCD00004387 |
| Molecular Formula | C11H12O4 |
| Molecular Weight | 208.2106 |
| SMILES | COC1=C(OC)C=C(C=CC(O)=O)C=C1 |
| UNII | BVZ841PVJL |
| Synonyms | 3,4-dimethoxycinnamic acid,
3-(3,4-dimethoxyphenyl)propenoic acid,
3-(3,4-dimethoxyphenyl)propenoic acid, (E)-isomer,
3,4-DIMETHOXYCINNAMIC ACID,
2316-26-9,
Dimethylcaffeic acid,
14737-89-4,
Caffeic acid dimethyl ether,
Dimethyl caffeic acid,
(2E)-3-(3,4-dimethoxyphenyl)prop-2-enoic acid,
(2E)-3-(3,4-dimethoxyphenyl)acrylic acid,
3-(3,4-Dimethoxyphenyl)propenoic acid,
(E)-3,4-dimethoxycinnamic acid,
UNII-BVZ841PVJL,
3-(3,4-Dimethoxyphenyl)-2-propenoic Acid,
3,4-Dimethoxy cinnamic acid,
(E)-3-(3,4-dimethoxyphenyl)acrylic acid,
3-(3,4-dimethoxyphenyl)acrylic acid,
(E)-3',4'-Dimethoxycinnamic acid,
MFCD00004387,
BVZ841PVJL,
3,4-Dimethoxyphenyl-2-propenoic acid,
3, 4-Dimethoxycinnamic acid,
3',4'-dimethoxycinnamic acid,
CHEMBL320295,
CHEBI:86549,
NSC4323,
trans-3,4-Dimethoxycinnamic acid,
(E)-3-(3,4-dimethoxyphenyl)prop-2-enoic acid,
3,4-Dimethoxycinnamic acid, predominantly trans,
HJBWJAPEBGSQPR-GQCTYLIASA-N,
2-Propenoic acid, 3-(3,4-dimethoxyphenyl)-, (2E)-,
(E)-3-(3,4-Dimethoxy-phenyl)-acrylic acid,
Cinnamic acid,4-dimethoxy-,
(2E)-3-(3,4-Dimethoxyphenyl)-2-propenoic acid,
W-107420,
2-Propenoic acid,4-dimethoxyphenyl)-,
SMR000112198,
3-(3,4-dimethoxyphenyl)prop-2-enoic acid,
(e)-3-(3,4-dimethoxyphenyl)-2-propenoic acid,
3,4-Dimethoxycinnamic acid, 99%, predominantly trans isomer,
3-(3,4-dimethoxy-phenyl)-acrylic acid,
AK-89652,
AK323813,
3,4-Dimethoxycinnamic acid, (E)-,
EINECS 238-801-4,
PubChem8267,
3,4-Dimethoxy[7,8,9,-13C3]-cinnamic Acid,
AC1LET0J,
AC1Q5RAL,
Spectrum5_000142,
bmse010210,
O,O'-Dimethylcaffeic Acid,
3-4-dimethoxycinnamic-acid,
AC1Q46HL,
3,4-dimethoxy-cinnamic acid,
cinnamic acid,3,4-dimethoxy,
SCHEMBL81317,
BSPBio_001672,
SPECTRUM210567,
MLS000570053,
MLS002695959,
BIDD:ER0423,
SPECTRUM1505130,
ARONIS023564,
E)-3,4-Dimethoxycinnamic acid,
3,4-Dimethoxybenzeneacrylic acid,
BBB/229,
(E)-3,4-dimethoxy cinnamic acid,
3,4-dimethoxy-trans-cinnamic acid,
3,4-Dimethoxycinnamic acid, 8CI,
HMS2268F17,
ZINC116202,
1185241-38-6,
ACT13062,
ALBB-004705,
BB_NC-00397,
HY-N1778,
NSC-4323,
NSC43569,
ZX-AL002152,
ZX-AN004651,
ZX-AS003468,
ZX-AT018225,
BBL009859,
BDBM50341141,
CCG-38678,
NSC-43569,
OR6575,
SBB005722,
STK298625,
AKOS000119628,
AC-8314,
AN-8131,
BBV-201132,
CS-W020726,
MCULE-4648711215,
RP17505,
RTR-010813,
SDCCGMLS-0066525.P001,
VZ33918,
NCGC00095522-01,
NCGC00095522-02,
NCGC00095522-03,
4CN-2862,
AJ-11508,
SC-02686,
SC-70733,
ST097456,
AB0008393,
AB0071555,
AB1000947,
TL8001930,
TR-010813,
D1728,
ST24041414,
TL80090024,
M-2122,
3-(3,4-Dimethoxyphenyl)-(E)-2-Propenoic acid,
trans-3-(3,4-Dimethoxyphenyl)prop-2-enoic acid,
3-(3,4-Dimethoxyphenyl)-2-propenoic acid, 9CI,
7R-0613,
A113300,
AE-641/01606018,
SR-01000712420,
2-Propenoic acid,3-(3,4-dimethoxyphenyl)-,(E)-,
I01-1879,
J-010506,
SR-01000712420-2,
2-Propenoic acid, 3-(3,4-dimethoxyphenyl)-, (E)-,
2-Propenoic acid,3-(3,4-dimethoxyphenyl)-, (2E)-,
3,4-Dimethoxycinnamic acid, predominantly trans, 99%,
BRD-K96256403-001-05-0,
I14-10526,
49C7DB89-C3D8-411B-B043-A8335FDDD98E,
F3095-1806,
InChI=1/C11H12O4/c1-14-9-5-3-8(4-6-11(12)13)7-10(9)15-2/h3-7H,1-2H3,(H,12,13)/b6-4,
3,4-Dimethoxycinnamicacid,
trans-3,4-Dimethoxyzimtsaure,
C11H12O4,
Cinnamic acid, 3,4-dimethoxy-,
trans-2,4-Dimethoxycinnamic acid,
NSC 4323,
EINECS 219-025-5,
AR-1E6511,
CID717531,
NSC 43569,
C11-H12-O4,
AI3-24427,
2-Propenoic acid, 3-(3,4-dimethoxyphenyl)-,
trans-3-(3,4-Dimethoxyphenyl)-2-propensaure,
3,4-Dimethoxycinnamic acid, 99% - 25G 25g,
C065784,
3-(3,4-dimethoxyphenyl)propenoic acid, (E)-isomer,
23312-67-6,
|
| Complexity | 237 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 1 |
| Exact Mass | 208.074g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 15 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 208.213g/mol |
| Monoisotopic Mass | 208.074g/mol |
| Rotatable Bond Count | 4 |
| Topological Polar Surface Area | 55.8A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.8 |
| Symbol: | |
| Hazard Class | |
| Hazard statements | H315-H319-H335 |
| Packing Group | |
| Precautionary statements | P261-P305+P351+P338 |
| UN Code |
| Chemical Name: | Batch Number: | |
| Chemical Structure: | CAS Registry No: | |
| Product ID: | ||
| Manufacture Date: | ||
| Storage Temperature: | ||
| Formula: | ||
| Molecular Weight: | ||
| Quantity: |
| Test: | Result: |

