Home Aldehydes 857283-89-7
857283-89-7,MFCD07772825
Catalog No.:AA003HWY
857283-89-7 | 3-Pyrrolidin-1-ylbenzaldehyde
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250mg
98%
2 weeks  
$183.00   $128.00
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1g
98%
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$422.00   $295.00
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5g
98%
2 weeks  
$1,393.00   $975.00
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25g
98%
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$4,404.00   $3,083.00
  • Technical Information
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  • Technical Information
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Technical Information
Catalog Number:
AA003HWY
Chemical Name:
3-Pyrrolidin-1-ylbenzaldehyde
CAS Number:
857283-89-7
Molecular Formula:
C11H13NO
Molecular Weight:
175.2270
MDL Number:
MFCD07772825
IUPAC Name:
3-pyrrolidin-1-ylbenzaldehyde
InChI:
InChI=1S/C11H13NO/c13-9-10-4-3-5-11(8-10)12-6-1-2-7-12/h3-5,8-9H,1-2,6-7H2
InChI Key:
KELYFFMWYRNGTF-UHFFFAOYSA-N
SMILES:
O=Cc1cccc(c1)N1CCCC1
Properties
Computed Properties
 
Complexity:
175  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
175.1g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
175.231g/mol
Monoisotopic Mass:
175.1g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
20.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3  

Synonyms
 
857283-89-7 
3-Pyrrolidin-1-ylbenzaldehyde 
KELYFFMWYRNGTF-UHFFFAOYSA-N 
ZINC4277366 
ANW-44086 
KM2353 
MFCD07772825 
SBB089067 
AKOS002391967 
AC-2817 
RP02922 
VZ27246 
3-(Pyrrolidin-1-yl)benzaldehyde 
AJ-50107 
AN-13555 
AS-31264 
CJ-11818 
SY003047 
DB-056880 
TC-132831 
FT-0644962 
ST24028360 
Y4312 
3-(1-pyrrolidinyl)benzaldehyde 
MFCD07772825 (97+%) 
A841432 
J-510967 
I01-10029 
C11H13NO 
ZINC04277366 
CID7164600 
Benzaldehyde,3-(1-pyrrolidinyl)- 
3-pyrrolidinylbenzaldehyde 
AC1OGC39 
SCHEMBL1443579 
KS-00000AXY 
DTXSID30428192 
Literature
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