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775554-97-7 | Benzenemethanamine, 4-methyl-N-nitroso- (9CI)
CAS No: 775554-97-7 Catalog No: AG005GSM MDL No:
Product Description
Catalog Number:
AG005GSM
Chemical Name:
Benzenemethanamine, 4-methyl-N-nitroso- (9CI)
CAS Number:
775554-97-7
Molecular Formula:
C8H10N2O
Molecular Weight:
150.1778
IUPAC Name:
N-[(4-methylphenyl)methyl]nitrous amide
InChI:
InChI=1S/C8H10N2O/c1-7-2-4-8(5-3-7)6-9-10-11/h2-5H,6H2,1H3,(H,9,11)
InChI Key:
RBWYYWGEAYBNOE-UHFFFAOYSA-N
SMILES:
O=NNCc1ccc(cc1)C
Properties
Complexity:
119
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
150.079g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
150.181g/mol
Monoisotopic Mass:
150.079g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
41.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.9
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