Home Imidazoles 5465-29-2
5465-29-2,MFCD00087477
Catalog No.:AA003HTX
5465-29-2 | 2-Propyl-1h-benzimidazole
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Technical Information
Catalog Number:
AA003HTX
Chemical Name:
2-Propyl-1h-benzimidazole
CAS Number:
5465-29-2
Molecular Formula:
C10H12N2
Molecular Weight:
160.2157
MDL Number:
MFCD00087477
IUPAC Name:
2-propyl-1H-benzimidazole
InChI:
InChI=1S/C10H12N2/c1-2-5-10-11-8-6-3-4-7-9(8)12-10/h3-4,6-7H,2,5H2,1H3,(H,11,12)
InChI Key:
FBLJZPQLNMVEMR-UHFFFAOYSA-N
SMILES:
CCCc1nc2c([nH]1)cccc2
UNII:
ZAS7IXN9P8
Properties
Computed Properties
 
Complexity:
147  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
160.1g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
160.22g/mol
Monoisotopic Mass:
160.1g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
28.7A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
2.5  

Synonyms
 
2-Propylbenzimidazole 
5465-29-2 
NSC 28962 
ZAS7IXN9P8 
2-Propyl-1H-benzoimidazole 
BRN 0118511 
CHEMBL348508 
FBLJZPQLNMVEMR-UHFFFAOYSA-N 
F0293-0118 
PubChem21433 
Enamine_005118 
AC1L2IQ7 
2-Propyl-1H-benzimidazole 
AC1Q2V1Z 
1H-Benzimidazole,2-propyl- 
5-23-06-00498 (Beilstein Handbook Reference) 
MLS000564234 
2-Propyl-1H-benzimidazole # 
SCHEMBL612507 
2-propyl-1H-1,3-benzimidazole 
CTK5A2094 
DTXSID30203108 
HMS1408I14 
2-propyl-1H-benzo[d]imidazole 
HMS2411G15 
ZINC394878 
ACT06472 
ALBB-016087 
BCP26962 
NSC28962 
NSC40172 
ANW-51617 
BDBM50404849 
MFCD00087477 
1H-Benzimidazole, 2-propyl- 
NSC-28962 
NSC-40172 
SBB042551 
STL168975 
AKOS000271113 
CS-W002355 
DS-0770 
FS-2307 
MCULE-6935692386 
TRA0063250 
2-propyl-1H-1,3-benzodiazole 
IDI1_007705 
NCGC00246151-01 
AJ-21453 
AK-31915 
BR-31915 
CJ-03643 
LS-33154 
SC-27880 
SC-64932 
SMR000151838 
BENZIMIDAZOLE, 2-PROPYL- 
ST088783 
SY015986 
AB0025421 
DB-025928 
ST2410204 
TC-061764 
4CH-013544 
AM20040687 
BB 0218033 
FT-0083496 
NSC 40172 
FT-0649871 
W6884 
A15643 
S-2905 
MFCD00087477 (95+%) 
465P292 
I01-1188 
Q-101094 
InChI=1/C10H12N2/c1-2-5-10-11-8-6-3-4-7-9(8)12-10/h3-4,6-7H,2,5H2,1H3,(H,11,12 
C10H12N2 
1H-Benzimidazole, 2-propyl- (9CI) 
CID21624 
ACN-029807 
C10-H12-N2 
UNII-ZAS7IXN9P8 
Literature

Title: Microsphere-based protease assays and screening application for lethal factor and factor Xa.

Journal: Cytometry. Part A : the journal of the International Society for Analytical Cytology 20060501

Title: Functions of the D-ribosyl moiety and the lower axial ligand of the nucleotide loop of coenzyme B(12) in diol dehydratase and ethanolamine ammonia-lyase reactions.

Journal: Journal of biochemistry 20021201

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