4-(Dimethylamino)-2-butenoic acid hydrochloride - CAS 98548-81-3
Catalog: |
BB042184 |
Product Name: |
4-(Dimethylamino)-2-butenoic acid hydrochloride |
CAS: |
98548-81-3 |
Synonyms: |
(E)-4-(dimethylamino)but-2-enoic acid;hydrochloride |
IUPAC Name: | (E)-4-(dimethylamino)but-2-enoic acid;hydrochloride |
Description: | 4-(Dimethylamino)-2-butenoic acid hydrochloride (CAS# 98548-81-3) is a useful research chemical compound. |
Molecular Weight: | 165.62 |
Molecular Formula: | C6H11NO2 · HCl |
Canonical SMILES: | CN(C)CC=CC(=O)O.Cl |
InChI: | InChI=1S/C6H11NO2.ClH/c1-7(2)5-3-4-6(8)9;/h3-4H,5H2,1-2H3,(H,8,9);1H/b4-3+; |
InChI Key: | UUHNQHFOIVLAQX-BJILWQEISA-N |
Purity: | 95 % |
LogP: | 0.99080 |
GHS Hazard Statement: | H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation] |
Precautionary Statement: | P264, P280, P305+P351+P338, and P337+P313 |
Signal Word: | Warning |
Publication Number | Title | Priority Date |
WO-2021211864-A1 | Fused tricyclic kras inhibitors | 20200416 |
EP-3892614-A1 | (1h-indol-5-yl)acrylamide derivatives as inhibitors of tead proteins and the hippo-yap1/taz signaling cascade for the treatment of cancer | 20200407 |
WO-2021204823-A1 | (1 h-indol-5-yl)acrylamide derivatives as inhibitors of tead proteins and the hippo-yap1/taz signaling cascade for the treatment of cancer | 20200407 |
EP-3868759-A1 | 2,3,5-substituted pyrrolo[2,3-b]pyridines as erbb modulators useful for treating cancer | 20200220 |
CN-112159405-A | Pyridopyrimidinone compounds and application thereof | 20200204 |
Complexity: | 118 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 2 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 1 |
Exact Mass: | 165.0556563 |
Formal Charge: | 0 |
Heavy Atom Count: | 10 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 2 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 165.0556563 |
Rotatable Bond Count: | 3 |
Topological Polar Surface Area: | 40.5 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
Online Inquiry
Customer Support
Customer Centered
Related Functional Groups
Nitrogen Compounds
Customers Also Viewed
INDUSTRY LEADERS TRUST OUR PRODUCTS