1-chloro-2-(cyclopropylmethoxy)-4-methyl-5-nitrobenzene

1-chloro-2-(cyclopropylmethoxy)-4-methyl-5-nitrobenzene

CAS: 2231675-23-1

Formula: C11H12ClNO3

SMILES: CC1=C(C=C(Cl)C(OCC2CC2)=C1)[N+]([O-])=O

IUPAC: 1-chloro-2-(cyclopropylmethoxy)-4-methyl-5-nitrobenzene

InChI: InChI=1S/C11H12ClNO3/c1-7-4-11(16-6-8-2-3-8)9(12)5-10(7)13(14)15/h4-5,8H,2-3,6H2,1H3

Composition: C (54.67%), H (5.01%), Cl (14.67%), N (5.80%), O (19.86%)

Molar Mass: 241.67

Atom Count: 28

Heavy Atom Count: 16

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	241.050571
Formal Charge	0
FSP3	0.45
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	0
InChIKey	MCTXXVYMXYWIRE-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	60.63
Topological Polar Surface Area	52.37
Polarizability	23.23
Ring Count	2
Rotatable Bond Count	4

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97%	<7 Days	2231675-23-1		$153.34-$969.60$153.34$184.20$263.67$364.65$969.60

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