Home Aldehydes 101682-68-2
101682-68-2,MFCD00968939
Catalog No.:AA00054A
101682-68-2 | 3-Bromo-4-nitrobenzaldehyde
Pack Size
Purity
Availability
Price(USD)
Quantity
  
1g
98%
in stock  
$143.00   $100.00
- +
5g
98%
in stock  
$477.00   $334.00
- +
10g
98%
in stock  
$858.00   $600.00
- +
25g
98%
in stock  
$1,715.00   $1,200.00
- +
  • Technical Information
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  • Q & A
  • Technical Information
  • Properties
  • Literature
Technical Information
Catalog Number:
AA00054A
Chemical Name:
3-Bromo-4-nitrobenzaldehyde
CAS Number:
101682-68-2
Molecular Formula:
C7H4BrNO3
Molecular Weight:
230.0156
MDL Number:
MFCD00968939
IUPAC Name:
3-bromo-4-nitrobenzaldehyde
InChI:
InChI=1S/C7H4BrNO3/c8-6-3-5(4-10)1-2-7(6)9(11)12/h1-4H
InChI Key:
ZVNHPTMSLSAAET-UHFFFAOYSA-N
SMILES:
O=Cc1ccc(c(c1)Br)[N+](=O)[O-]
Properties
Computed Properties
 
Complexity:
192  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
228.937g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
230.017g/mol
Monoisotopic Mass:
228.937g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
62.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2  

Synonyms
 
3-bromo-4-nitrobenzaldehyde 
101682-68-2 
KSC494G1T 
Benzaldehyde,3-bromo-4-nitro- 
CTK3J4319 
KS-00000KYD 
DTXSID40396191 
ZVNHPTMSLSAAET-UHFFFAOYSA-N 
ACT10405 
ZINC5427010 
ANW-47841 
MFCD00968939 
Benzaldehyde, 3-bromo-4-nitro- 
AKOS015890177 
AC-9224 
AM84045 
AN-7211 
CB-3141 
CS-W006816 
FCH1332231 
RP27858 
RTC-061313 
3-Bromo-4-nitrobenzaldehyde, AldrichCPR 
AK-32665 
AJ-54068 
BC002732 
BR-32665 
CC-14455 
CJ-12613 
DS-11889 
EN001899 
SC-00091 
AB0034419 
AX8040131 
Q-102469 
DB-012657 
ST2410531 
TC-061313 
4CH-013852 
FT-0081552 
FT-0642459 
X8572 
A-2040 
682B682 
C-29367 
3-bromo-4-nitro-benzaldehyde 
I01-5246 
C7H4BrNO3 
ACN-037848 
CID3770841 
A16283 
EPA 
PubChem4173 
AC1MXSTE 
ACMC-1C51H 
SCHEMBL99723 
Literature
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