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| CAS Number | 9045-22-1 |
| Catalog Number | AG00ILIV(AGN-PC-0VQKLH) |
| Chemical Name | Heparin, lithium salt |
| IUPAC Name | 3-phenylprop-2-enoic acid |
| InChI | InChI=1S/C9H8O2/c10-9(11)7-6-8-4-2-1-3-5-8/h1-7H,(H,10,11) |
| InChI Key | WBYWAXJHAXSJNI-UHFFFAOYSA-N |
| MDL Number | MFCD00131308 |
| Molecular Formula | C16H33NO20S3 |
| Molecular Weight | 655.6229 |
| SMILES | C.C1(COS(=O)(=O)O)OC(OC)C(NS(=O)(=O)O)C(O)C1OC1OC(C(=O)O)C(OC)C(O)C1OS(=O)(=O)O.C |
| Synonyms | 2 Propenoic acid, 3 phenyl,
2-Propenoic acid, 3-phenyl-,
3-phenyl- 2-Propenoic acid,
Innohep,
tinzaparin,
tinzaparin sodium,
2-Propenoic acid, 3-phenyl-,
Cinnamic acid(only trans),
Kyselina skoricove,
(Z)-3-phenylacrylic acid,
beta-Phenylacrylic acid,
2-Propenoicacid, 3-phenyl-,
Cinnamylic acid,
3-Phenyl-2-propenoic acid,
WBYWAXJHAXSJNI-UHFFFAOYSA-N,
Acidum cinnamylicum,
NSC 9189,
Zimtsaeure [German],
Benzylideneacetic acid,
9045-22-1,
Cinnamic acid (natural),
.beta.-Phenylacrylic acid,
Kyselina skoricove [Czech],
FEMA No. 2288,
cinnamoic acid,
EINECS 210-708-3,
cinnamoyl alcohol,
trans-CinnamicAcid,
BRN 0507757,
AI3-00891,
Styrene Carboxylic Acid,
3-phenyl propenoic acid,
AC1L1ROY,
KSC174M0P,
KSC353A2F,
SCHEMBL5814771,
CTK0H4607,
CTK2F3022,
KS-00000CDH,
DTXSID40110056,
KS-000010XE,
ANW-20546,
CC0165,
AKOS016890705,
Cinnamic Acid,mixture of cis and trans,
MCULE-4051659199,
NSC 623441,
RP21202,
TRA0020031,
AK-47839,
AK114507,
DB-003617,
FT-0623829,
FT-0655071,
FT-0700804,
3295-EP2269610A2,
3295-EP2269988A2,
3295-EP2270002A1,
3295-EP2270008A1,
3295-EP2270011A1,
3295-EP2270113A1,
3295-EP2272935A1,
3295-EP2275401A1,
3295-EP2275413A1,
3295-EP2277848A1,
3295-EP2277867A2,
3295-EP2280003A2,
3295-EP2281563A1,
3295-EP2284160A1,
3295-EP2284178A2,
3295-EP2284179A2,
3295-EP2287156A1,
3295-EP2289510A1,
3295-EP2289890A1,
3295-EP2292593A2,
3295-EP2292617A1,
3295-EP2298735A1,
3295-EP2298753A1,
3295-EP2301931A1,
3295-EP2301937A1,
3295-EP2305257A1,
3295-EP2305646A1,
3295-EP2305651A1,
3295-EP2305687A1,
3295-EP2308848A1,
3295-EP2308851A1,
3295-EP2308854A1,
3295-EP2308858A1,
3295-EP2308868A1,
3295-EP2311807A1,
3295-EP2311816A1,
3295-EP2311817A1,
3295-EP2311842A2,
3295-EP2314593A1,
3295-EP2316457A1,
3295-EP2316458A1,
3295-EP2316459A1,
3295-EP2316825A1,
3295-EP2316826A1,
3295-EP2316827A1,
3295-EP2316828A1,
Z955123558,
CINNAMIC ACID,
heparin,
Tinzaparin,
Zimtsaeure,
Innohep,
TRANS-CINNAMIC ACID,
Isocinnamic acid,
Thromboliquine,
Certoparin,
Dalteparin,
Fraxiparin,
Heparinate,
Multiparin,
Nadroparin,
Nadroparine,
Novoheparin,
Parnaparin,
Parvoparin,
Sandoparin,
Sublingula,
Ardeparin,
Bemiparin,
Clivarin,
Clivarine,
Heparina,
Heparine,
Heparinum,
Hepathrom,
Liquaemin,
Liquemin,
Logiparin,
Octaparin,
Panheprin,
Reviparin,
Subeparin,
Tinzaparin sodium,
Triofiban,
3-Phenylacrylic acid,
Arteven,
Eparina,
Pabyrin,
Pularin,
Fluxum,
Vetren,
Heparin natrium,
Heparin sulfate,
Lithium heparin,
Heparin sodium,
Heparinic acid,
Phenylacrylic acid,
Sodium heparin,
alpha-Heparin,
Hed-heparin,
Lipo-hepin,
Ardeparin sodium,
Bemiparin sodium,
Depo-Heparin,
Reviparin sodium,
Liquaemin Sodium,
Allocinnamic acid,
Dalteparin sodium,
Enoxaparin sodium,
Parnaparin sodium,
Sodium heparinate,
Fragmin A,
Fragmin B,
Fragmin IV,
Hep-Lock,
Inno-Hep,
Heparinum natricum,
Vitrum AB,
cis-Cinnamic acid,
Minolteparin sodium,
Hepflush-10,
Heparin Lock Flush,
Heparin, lithium salt,
Normiflo (TN),
Sodium acid heparin,
3-Phenylpropenoic acid,
Eparina [DCIT],
(E)-Cinnamic acid,
Benzenepropenoic acid,
Hep-Lock U/P,
Liquaemin Lock Flush,
Heparin, sodium salt,
Heparin CY 216,
Lioton 1000,
Heparine [INN-French],
Heparinum [INN-Latin],
3-phenylprop-2-enoic acid,
Heparina [INN-Spanish],
cis-.beta.-Carboxystyrene,
D01ZJK,
Kabi 2165,
LHN 1,
2 Propenoic acid, 3 phenyl,
3-phenyl- 2-Propenoic acid,
621-82-9,
Ro 11,
Heparin sodium preservative Free,
Cy 222,
CID8784,
Liquaemin sodium preservative free,
ALFA 87-81,
WY 90493RD,
Hep Flush Kit in plastic container,
Heparin sodium in plastic container,
ALFA 87-120,
ALFA 87-163,
ALFA 87-198,
ALFA 88-247,
Heparin Lock Flush preservative free,
2-Propenoic acid, 3-phenyl-, (2E)-,
CY 216,
FR 860,
KB 101,
OP 386,
OP 622,
140-10-3,
Heparin Lock Flush in plastic container,
Heparinsodium 25,000 units in dextrose 5%,
Heparin sodium 10,000 units in dextrose 5%,
Heparin sodium 12,500 units in dextrose 5%,
H 2149,
C081247,
Heparin sodium 25,000 units insodium chloride 0.9%,
Heparin sodium 5,000 units in sodium chloride 0.9%,
Heparin sodium 5,000 units insodium chloride 0.45%,
D000078222,
Heparin Lock Flush preservative free in plastic container,
Heparin sodium 10,000 units in sodium chloride 0.45%,
Heparin sodium 10,000 units in sodium chloride 0.9%,
Heparin sodium 12,500 units in sodium chloride 0.9%,
Heparin sodium 1,000 units in dextrose 5% in plastic container,
Heparin sodium 10,000 units in dextrose 5%in plastic container,
Heparin sodium 12,500 units in dextrose 5% in plastic container,
Heparin sodium 2,000 units in dextrose 5% in plastic container,
Heparin sodium 20,000 units and dextrose 5% in plastic container,
Heparin sodium 20,000 units in dextrose 5% in plastic container,
Heparin sodium 25,000 units and dextrose 5% in plastic container,
Heparin sodium 25,000 units in dextrose 5% in plastic container,
Heparin sodium 5,000 units in dextrose 5% in plastic container,
102-94-3,
Heparin lithium salt, 170 units/mg, from porcine intestinal mucosa - 1G 1g,
Heparin sodium 1,000 units and sodium chloride 0.9% in plastic container,
Heparin sodium 1,000 units in sodium chloride 0.9% in plastic container,
Heparin sodium 12,500 units in sodium chloride 0.45% in plastic container,
Heparin sodium 2,000 units and sodium chloride 0.9% in plastic container,
Heparin sodium 2,000 units in sodium chloride 0.9% in plastic container,
Heparin sodium 25,000 units in sodium chloride 0.45% in plastic container,
Heparin sodium 25,000 units in sodium chloride 0.9% in plastic container,
Heparin sodium 5,000 units and sodium chloride 0.9% in plastic container,
Heparin sodium 5,000 units in sodium chloride 0.9% in plastic container,
9005-49-6,
|
| Complexity | 155 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 148.052g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 11 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 148.161g/mol |
| Monoisotopic Mass | 148.052g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 37.3A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 1 |
| XLogP3 | 2.1 |
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