1-(Boc-amino)-2-pyrrolecarbonitrile - CAS 937046-96-3
Catalog: |
BB041039 |
Product Name: |
1-(Boc-amino)-2-pyrrolecarbonitrile |
CAS: |
937046-96-3 |
Synonyms: |
N-(2-cyano-1-pyrrolyl)carbamic acid tert-butyl ester; tert-butyl N-(2-cyanopyrrol-1-yl)carbamate |
IUPAC Name: | tert-butyl N-(2-cyanopyrrol-1-yl)carbamate |
Description: | 1-(Boc-amino)-2-pyrrolecarbonitrile (CAS# 937046-96-3) is a useful research chemical. |
Molecular Weight: | 207.23 |
Molecular Formula: | C10H13N3O2 |
Canonical SMILES: | CC(C)(C)OC(=O)NN1C=CC=C1C#N |
InChI: | InChI=1S/C10H13N3O2/c1-10(2,3)15-9(14)12-13-6-4-5-8(13)7-11/h4-6H,1-3H3,(H,12,14) |
InChI Key: | SXUSNFHKHIJDRN-UHFFFAOYSA-N |
Appearance: | White to yellow solid |
Storage: | Inert atmosphere, Room Temperature |
MDL: | MFCD12068393 |
LogP: | 1.91138 |
Publication Number | Title | Priority Date |
WO-2020253458-A1 | Cdk kinase inhibitor | 20190618 |
WO-2020156982-A1 | The monohydrate of rogaratinib hydrochloride and solid states thereof | 20190131 |
CN-113382997-A | Monohydrate of hydrochloric acid Rogatinib and solid state thereof | 20190131 |
KR-20210119994-A | The monohydrate of rogaratinib hydrochloride and its solid state | 20190131 |
CN-110627796-A | Nitrogenous heterocyclic derivative and application thereof in medicine | 20180621 |
Complexity: | 287 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 207.100776666 |
Formal Charge: | 0 |
Heavy Atom Count: | 15 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 207.100776666 |
Rotatable Bond Count: | 3 |
Topological Polar Surface Area: | 67 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2.3 |
Online Inquiry
Customer Support
Customer Centered
Related Functional Groups
Pyrroles
Customers Also Viewed
-
[1408282-26-7]
8-Fluoro-4,5-dihydro-1H-azepino[5,4,3-CD]indol-6(3H)-one
-
[87117-22-4]
1,4-Bis(2-ethylhexyl)benzene
-
[34374-88-4]
2,4,6-Trihydroxybenzene-1,3,5-tricarbaldehyde
-
[822-87-7]
2-Chlorocyclohexanone
-
[953780-33-1]
(R)-1-[5-(2,2,2-Trifluoroethoxy)-2-pyridyl]ethylamine
-
[99-14-9]
Tricarballylic acid
INDUSTRY LEADERS TRUST OUR PRODUCTS