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100114-57-6,MFCD04970938
Catalog No.:AA0000XE
100114-57-6 | 1H-Pyrazole, 3-cyclopropyl-
Pack Size
Purity
Availability
Price(USD)
Quantity
  
1g
95%
in stock  
$88.00
- +
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  • Technical Information
  • Properties
  • Literature
Technical Information
Catalog Number:
AA0000XE
Chemical Name:
1H-Pyrazole, 3-cyclopropyl-
CAS Number:
100114-57-6
Molecular Formula:
C6H8N2
Molecular Weight:
108.1411
MDL Number:
MFCD04970938
IUPAC Name:
5-cyclopropyl-1H-pyrazole
InChI:
InChI=1S/C6H8N2/c1-2-5(1)6-3-4-7-8-6/h3-5H,1-2H2,(H,7,8)
InChI Key:
TXWDVWSJMDFNQY-UHFFFAOYSA-N
SMILES:
C1CC1c1cc[nH]n1
Properties
Computed Properties
 
Complexity:
88.5  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
108.069g/mol
Formal Charge:
0
Heavy Atom Count:
8  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
108.144g/mol
Monoisotopic Mass:
108.069g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
28.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.8  

Synonyms
 
3-cyclopropyl-1H-pyrazole 
100114-57-6 
3-cyclopropyl-2H-pyrazole 
ACMC-2097ms 
AC1Q1H6W 
1H-pyrazole, 5-cyclopropyl- 
SCHEMBL1608843 
CTK3J8558 
CTK4A5030 
KS-00000DQD 
TXWDVWSJMDFNQY-UHFFFAOYSA-N 
ALBB-018009 
5-Cyclopropyl-1H-pyrazole 
BCP02748 
ZINC4291288 
8385AC 
ANW-14162 
BBL016261 
SBB022440 
STK349804 
AKOS000311146 
AKOS002160523 
3-Cyclopropyl-1H-pyrazole, AldrichCPR 
5-cyclopropylpyrazole 
FH-0702 
LS20814 
MCULE-2113141671 
QC-3985 
RP00457 
RTR-039066 
SB16019 
WT82476 
NCGC00340626-01 
AJ-50372 
1H-Pyrazole, 3-cyclopropyl- 
AJ-50373 
AK-40938 
AM808021 
BR-40938 
CJ-11906 
SC-25153 
SC-50734 
SY004983 
AB0034336 
AB1000312 
1071497-79-4 
DB-014101 
DB-022297 
TC-307895 
TR-039066 
4CH-000484 
CS-0006099 
FT-0687742 
FT-0730544 
ST45115005 
X8472 
3-cyclopropylpyrazole 
EN300-54201 
A25432 
S-6020 
Z-3886 
AB01187101-03 
MFCD06739298 (97+%) 
W-204347 
I14-12867 
I14-17522 
I14-33934 
1H-Pyrazole,3-cyclopropyl- 
null 
1-2 weeks 
C6H8N2 
MFCD06739298 
MFCD10001553 
ZINC02538706 
ACN-046598 
CID7017816 
3-cyclopropyl-1H-pyrazole, 95% - 1G 1g 
1170796-66-3 
MFCD04970938 
2026-48-4 
3-Cyclopropyl-1H-Pyrazole 97+% 
Literature
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