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104-98-3,MFCD00149316
Catalog No.:AA003HWJ
104-98-3 | Urocanic acid
Pack Size
Purity
Availability
Price(USD)
Quantity
  
1g
95%
in stock  
$43.00   $30.00
- +
5g
95%
in stock  
$115.00   $80.00
- +
25g
95%
in stock  
$381.00   $267.00
- +
100g
95%
in stock  
$1,270.00   $889.00
- +
  • Technical Information
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Technical Information
Catalog Number:
AA003HWJ
Chemical Name:
Urocanic acid
CAS Number:
104-98-3
Molecular Formula:
C6H6N2O2
Molecular Weight:
138.1240
MDL Number:
MFCD00149316
IUPAC Name:
(E)-3-(1H-imidazol-5-yl)prop-2-enoic acid
InChI:
InChI=1S/C6H6N2O2/c9-6(10)2-1-5-3-7-4-8-5/h1-4H,(H,7,8)(H,9,10)/b2-1+
InChI Key:
LOIYMIARKYCTBW-OWOJBTEDSA-N
SMILES:
OC(=O)C=Cc1c[nH]cn1
EC Number:
203-258-4
UNII:
G8D26XJJ3B
Properties
Computed Properties
 
Complexity:
156  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
1  
Exact Mass:
138.043g/mol
Formal Charge:
0
Heavy Atom Count:
10  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
138.126g/mol
Monoisotopic Mass:
138.043g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
66A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0

Synonyms
 
Acid, Glyoxalinylacrylic 
Acid, Urocanic 
3465-72-3 
RTR-032578 
NCGC00094495-01 
NCGC00094495-02 
NCGC00094495-03 
NCGC00260524-01 
NCGC00261940-01 
CAS-104-98-3 
CJ-18538 
LS-78025 
SC-00208 
5-Imidazoleacrylic acid 
ST085933 
3-(1H-Imidazol-5-yl)-2-Propenoic acid 
3-Azonia-1H-imidazole-5-acrylic acidanion 
HY-113008 
TR-032578 
CS-0059340 
EU-0101255 
I0002 
R1116 
(E)-3-(1H-imidazol-4-yl)prop-2-enoic acid 
urocanate 
(E)-3-(1H-imidazol-5-yl)prop-2-enoic acid 
3-(1H-Imidazol-4-yl)-(E)-2-Propenoic acid 
C00785 
U 7500 
(2E)-3-(1H-imidazol-5-yl)prop-2-enoic acid 
(2E)-3-(3H-imidazol-4-yl)prop-2-enoic acid 
SR-01000076189 
I04-0134 
SR-01000076189-1 
W-108797 
Imidazole-4-acrylic acid 
23A7DA77-EC02-46B9-AA22-514C2B2A62E9 
3-(1h-imidazol-4-yl)-2-propenoicaci ;3-(1h-imidazol-4-yl)-2-propenoicacid 
cis-Urocanic acid 
trans-urocanate 
ProtoCure 
Acid, Urocanic 
-3- propenoicacid 
Glyoxalinylacrylic Acid 
Acid, Glyoxalinylacrylic 
3-imidazol-4-ylacrylsyre 
(2E)-3-(1H-IMIDAZOL-4-YL)ACRYLIC ACID 
D04CQV 
3-(1H-imidazol-4-yl)acrylic acid 
(Z)-Imidazole-4-acrylic acid 
C6H6N2O2 
3- imidazol- 4- ylacrylic acid 
C6-H6-N2-O2 
AR-1E5184 
CID736715 
(2E)-3-(1H-Imidazole-4-yl)propenoic acid 
2-Propenoic acid, 3-(1H-imidazol-5-yl)- 
3-Imidazol-4-ylacrylic acid 
A13624 
4-25-00-00786 (Beilstein Handbook Reference) 
D014560 
ProtoCure (emulsion, atopic dermatitis), Biocis Pharma 
ProtoCure (emulsion, atopic dermatitis/psoriasis), Laurantis 
Anti-inflammatory (topical emulsion, dermatological disease), BioCis 
Cis-UCA (topical emulsion, atopic dermatitis/psoriasis), Laurantis 
ProtoCure (emulsion, atopic dermatitis/psoriasis), Biocis Pharma 
7699-35-6 
Cis-UCA (topical emulsion, atopic dermatitis/psoriasis), BioCis Pharma 
3-(1H-Imidazol-4-yl)-2-propenoic acid 
URO 
Cis-urocanic acid (topical emulsion, atopic dermatitis/psoriasis), BioCis Pharma 
10557-55-8 
(2E)-3-(1H-imidazol-4-yl)prop-2-enoic acid 
UNII-G8D26XJJ3B 
(E)-3-(1H-Imidazol-4-yl)-2-propenoic acid 
Glyoxalinylacrylic Acid 
2-Propenoic acid, 3-(1H-imidazol-4-yl)- 
NSC 66357 
UROCANIC ACID, CIS 
G8D26XJJ3B 
(e)-3-(1h-imidazol-4-yl)acrylic acid 
3-(4-Imidazolyl)acrylic acid 
MLS000069482 
CHEBI:30817 
LOIYMIARKYCTBW-OWOJBTEDSA-N 
2-Propenoic acid, 3-(1H-imidazol-4-yl)-, (2E)- 
Urocanic Acid 
(E)-3-(1H-imidazol-5-yl)acrylic acid 
3-(1H-imidazol-4-yl)prop-2-enoic acid 
SMR000059098 
Imidazole-4-propene-2-enoic acid [Urocanic acid] 
4-IMIDAZOLE ACRYLIC ACID DIHYDRATE 
CCRIS 3414 
EINECS 203-258-4 
(E)-Urocanic acid 
BRN 0081405 
(2E)-3-imidazol-4-ylprop-2-enoic acid 
urocanic acid 
(E)-3-(imidazol-4-yl)propenoate 
5-Imidazoleacrylate 
zlchem 24 
MFCD00005203 
Imidazole-4-acrylate 
imidazolylpropenoicacid 
PubChem9875 
(E)-3-(1H-Imidazol-5-yl)-2-propenoic acid 
(Z)-3-(3H-imidazol-4-yl)prop-2-enoic Acid 
AC1LEIQR 
4-imidazoleacrylic acid 
Opera_ID_26 
3-(4-Imidazolyl)acrylate 
bmse000279 
AC1Q5T9G 
AC1Q71IX 
DSSTox_CID_21148 
DSSTox_RID_79635 
DSSTox_GSID_41148 
Lopac0_001255 
SCHEMBL15417 
trans-Urocanic acid 
trans-4-imidazoleacrylic acid 
MLS001148240 
2-Propenoic acid, 3-(1H-imidazol-4-yl)-, (E)- 
4-Imidazoleacrylic acid, 99% 
AC1Q71Y1 
Jsp000483 
3-(1H-Imidazol-4-yl)acrylate 
CHEMBL1236602 
DTXSID5041148 
CHEBI:27248 
104-98-3 
ZLB0011 
E-3-(4-imidazolyl)propenoic acid 
HMS2234N08 
HMS3263L12 
ACT02032 
ALBB-025618 
NSC66357 
(E)-3-(4-Imidazolyl)acrylic acid 
Tox21_202978 
Tox21_501255 
Urocaninic acid 
BBL027507 
MFCD01593677 
NSC-66357 
NSC407934 
SBB006702 
STK735136 
ZINC34633903 
(E)-3-(imidazol-4-yl)acrylic acid 
3-(3H-Imidazol-4-yl)-acrylic acid 
3-(1H-Imidazol-4-yl)-2-propenoate 
imidazoleacrylic acid 
AKOS001745677 
AKOS005265082 
AKOS022488522 
(e)-3-(Imidazol-4-yl)propenoic acid 
CCG-205329 
DB01971 
HS-0075 
LP01255 
NSC-407934 
RP09780 
Literature
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