4-(4-Aminobutyl)-5-phenyl-1,2-dihydro-3h-pyrazol-3-one - CAS 878208-91-4
Catalog: |
BB075052 |
Product Name: |
4-(4-Aminobutyl)-5-phenyl-1,2-dihydro-3h-pyrazol-3-one |
CAS: |
878208-91-4 |
Synonyms: |
4-(4-aminobutyl)-5-phenyl-1,2-dihydro-3H-pyrazol-3-one; 4-(4-aminobutyl)-5-phenyl-1,2-dihydropyrazol-3-one; 4-(4-Aminobutyl)-5-phenyl-1H-pyrazol-3(2H)-one |
IUPAC Name: | 4-(4-aminobutyl)-5-phenyl-1,2-dihydropyrazol-3-one |
Description: | 4-(4-Aminobutyl)-5-phenyl-1,2-dihydro-3h-pyrazol-3-one |
Molecular Weight: | 231.29 |
Molecular Formula: | C13H17N3O |
Canonical SMILES: | C1=CC=C(C=C1)C2=C(C(=O)NN2)CCCCN |
InChI: | InChI=1S/C13H17N3O/c14-9-5-4-8-11-12(15-16-13(11)17)10-6-2-1-3-7-10/h1-3,6-7H,4-5,8-9,14H2,(H2,15,16,17) |
InChI Key: | PDGMFQCOHDOSBW-UHFFFAOYSA-N |
Complexity: | 306 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 231.137162174 |
Formal Charge: | 0 |
Heavy Atom Count: | 17 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 3 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 231.137162174 |
Rotatable Bond Count: | 5 |
Topological Polar Surface Area: | 67.2Ų |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.4 |
-
Catalog: BB054600
3-glycidoxypropyltrimethoxysilane
Detail
-
Catalog: BB054808
2-(4-Aminooxan-3-yl)acetic Acid
Detail
-
Catalog: BB016397
1-methyl-3-(1,3-thiazol-2-yl)-1H-pyrazole-5-carbaldehyde
Detail
-
Catalog: BB012200
8-(tetramethyl-1,3,2-dioxaborolan-2-yl)-4H-chromen-4-one
Detail
-
Catalog: BB016437
2-amino-3-{pyrrolo[2,1-f][1,2,4]triazin-5-yl}propanenitrile
Detail
-
Catalog: BB012925
6-(Dimethylamino)-2-naphthaldehyde
Detail
-
Catalog: BB016398
4-chloro-6-methylimidazo[2,1-f][1,2,4]triazine
Detail
-
Catalog: BB077194
(S)-(-)-1,2-epoxydecane
Detail
Online Inquiry
Customer Support
Customer Centered
Related Functional Groups
Other Building Blocks
Customers Also Viewed
INDUSTRY LEADERS TRUST OUR PRODUCTS