Home Nitro Compounds 23876-13-3
23876-13-3,MFCD00007166
Catalog No.:AA003HJX
23876-13-3 | 2-Methyl-3-nitrobenzyl alcohol
Pack Size
Purity
Availability
Price(USD)
Quantity
  
1g
97%
in stock  
$16.00
- +
5g
97%
in stock  
$55.00
- +
10g
97%
in stock  
$106.00
- +
25g
97%
in stock  
$224.00
- +
  • Technical Information
  • Properties
  • Literature
  • Request for Quotation
  • Technical Information
  • Properties
  • Literature
Technical Information
Catalog Number:
AA003HJX
Chemical Name:
2-Methyl-3-nitrobenzyl alcohol
CAS Number:
23876-13-3
Molecular Formula:
C8H9NO3
Molecular Weight:
167.1620
MDL Number:
MFCD00007166
IUPAC Name:
(2-methyl-3-nitrophenyl)methanol
InChI:
InChI=1S/C8H9NO3/c1-6-7(5-10)3-2-4-8(6)9(11)12/h2-4,10H,5H2,1H3
InChI Key:
QJANIQCEDPJNLO-UHFFFAOYSA-N
SMILES:
OCc1cccc(c1C)[N+](=O)[O-]
EC Number:
245-923-1
Properties
Computed Properties
 
Complexity:
166  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
167.058g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
167.164g/mol
Monoisotopic Mass:
167.058g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
66A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.6  

Synonyms
 
2-Methyl-3-nitrobenzyl alcohol 
23876-13-3 
PubChem7468 
ACMC-1CCQT 
AC1Q1ZZS 
AC1L3JO3 
SCHEMBL715298 
2-methyl-3-nitrophenylmethanol 
2-Methyl-3-nitro benzylalcohol 
CTK4F2474 
DAlc2-H_000050 
2-Methyl-3-nitro benzyl alcohol 
(2-Methyl-3-nitrophenyl)methanol 
DTXSID20178578 
Benzenemethanol,2-methyl-3-nitro- 
KS-00000MK9 
ZINC2567947 
(2-Methyl-3-nitrophenyl)methanol # 
ANW-59502 
MFCD00007166 
SBB064030 
AKOS009156888 
2-Methyl-3-nitrobenzyl alcohol, 99% 
2-methyl-3-nitroBenzenemethanol 
MCULE-4116063695 
VZ24923 
3-hydroxymethyl-2-methyl-1-nitrobenzene 
AJ-41519 
AK-34284 
AS-17900 
SC-02764 
DB-021338 
DB-071770 
TC-062336 
Benzenemethanol, 2-methyl-3-nitro- 
AM20030418 
FT-0638363 
ST24040837 
ST51038020 
V2409 
L-1190 
I01-3730 
J-015255 
InChI=1/C8H9NO3/c1-6-7(5-10)3-2-4-8(6)9(11)12/h2-4,10H,5H2,1H 
C8H9NO3 
2-Methyl-3-nitrobenzylalcohol 
C8-H9-N-O3 
KST-1A3081 
CID90289 
AR-1A2492 
ZINC02567947 
2445-67-2 
5400-78-2 
QJANIQCEDPJNLO-UHFFFAOYSA-N 
(2-methyl-3-nitrophenyl)methan-1-ol 
EINECS 245-923-1 
(2-methyl-3-nitro-phenyl)-methanol 
Literature

Title: (2-Methyl-3-nitro-phen-yl)methanol.

Journal: Acta crystallographica. Section E, Structure reports online 20090801

Quotation Request
Company Name:
*
Contact Person:
*
Email:
*
Quantity Required:
*
Additional Info: