Home Nitros Benzenemethanol, alpha-methyl-2-nitro-, (alphaR)- (9CI)

Benzenemethanol, alpha-methyl-2-nitro-, (alphaR)- (9CI)

CAS No.:
108530-03-6
Catalog Number:
AG008SDK
Molecular Formula:
C8H9NO3
Molecular Weight:
167.1620
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Product Description
Catalog Number:
AG008SDK
Chemical Name:
Benzenemethanol, alpha-methyl-2-nitro-, (alphaR)- (9CI)
CAS Number:
108530-03-6
Molecular Formula:
C8H9NO3
Molecular Weight:
167.1620
MDL Number:
MFCD18339600
IUPAC Name:
(1R)-1-(2-nitrophenyl)ethanol
InChI:
InChI=1S/C8H9NO3/c1-6(10)7-4-2-3-5-8(7)9(11)12/h2-6,10H,1H3/t6-/m1/s1
InChI Key:
DSDBYQDNNWCLHL-ZCFIWIBFSA-N
SMILES:
[O-][N+](=O)c1ccccc1[C@H](O)C
Properties
Complexity:
166  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
1  
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:
1.5  
Properties