4-Methylphthalazin-1-amine

CAT: 0926-EAA77685-01Size: 50 mgDry Ice: NoHazardous: No

1 / 1

CAT#:0926-EAA77685-01Size:50 mg

Selected

24/48H Stock Items & 2 to 6 Weeks non Stock Items.

Quick Request Actions

CAS Number

4776-85-6

MDL Number

MFCD00458086

Smiles

CC1=NN=C (C2=CC=CC=C12) N

Molecular Formula

C9H9N3

Molecular Weight

159.19 g/mol

Controlled

Chemical Information

4-Methylphthalazin-1-amine

CAS Number	4776-85-6
PubChem CID	6401334
IUPAC Name	4-methylphthalazin-1-amine
Molecular Formula	C9H9N3
Molecular Weight	159.19
XLogP	1.1
Topological Polar Surface Area	51.8
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	0
Heavy Atom Count	12
Formal Charge	0
Complexity	160

SMILES

CC1=NN=C(C2=CC=CC=C12)N

InChI

InChI=1S/C9H9N3/c1-6-7-4-2-3-5-8(7)9(10)12-11-6/h2-5H,1H3,(H2,10,12)

InChIKey

AQHQGNYQXCIWDG-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 4776-85-6

CID: 6401334

Formula: C9H9N3

MW: 159.19

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	159.19
XLogP3	1.1
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	0
Exact Mass	159.079647300
Monoisotopic Mass	159.079647300
Topological Polar Surface Area	51.8 Å²
Heavy Atom Count	12
Formal Charge	0
Complexity	160
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes

Catalog	Name
NKD04407-01	1- (4-Methylphthalazin-1-yl) piperidin-4-amine dihydrochloride
EXB13241-01	N-Methyl-1- (4-methylphthalazin-1-yl) piperidin-4-amine
BHB15087-01	1,4,4-Trimethylcyclohexan-1-amine
IIB45419-01	4,4-Dimethylcycloheptan-1-amine
NAA58086-01	4-Chlorophthalazin-1-amine
YRB92127-01	1-Cyclobutylpiperidin-4-amine
UCA79831-01	4-Ethoxynaphthalen-1-amine
DDA48445-01	4-Methanesulfonylpiperazin-1-amine
ABA83495-01	4-Ethylcycloheptan-1-amine
RAA72866-01	4-Phenoxybutan-1-amine

Catalog	Name
OR93692-01	2- (4-Chlorophenyl) -4-methylphthalazin-1 (2H) -one
GTR19251313-01	2-Methylphthalazin-1-one
OR1060379-01	2-Methylphthalazin-1 (2H) -one
OR1029355-01	4,4-Dimethoxybutan-1-Amine
PC901499-01	4,4-Difluorocyclohexan-1-amine
433511-01	4,4-Dimethylcyclohexan-1-amine
AN KA 1219-01	4,4-dimethylpentan-1-amine
OR95637-01	[1,1':4',1''-Terphenyl]-4-amine
897671-75-9-01	[1,1',4',1''-Terphenyl]-4-amine
RG-M200861-01	4-Methylpiperazin-1-Amine