2-Methyl-1,2-Propanediamine

CAT: 0127-OR1030584-01Size: 1 mLDry Ice: NoHazardous: No

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CAT#:0127-OR1030584-01Size:1 mL

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CAS Number

811-93-8

Synonyms

2-methylpropane-1,2-diamine

MDL Number

MFCD00008054

Purity

98%

Smiles

CC(C)(CN)N

Chemical Information

2-Methylpropylenediamine

1,2-diamino-2-methylpropane is an alkylamine.

CAS Number	811-93-8
PubChem CID	13128
IUPAC Name	2-methylpropane-1,2-diamine
Molecular Formula	C4H12N2
Molecular Weight	88.15
XLogP	-1
Topological Polar Surface Area	52
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	1
Heavy Atom Count	6
Formal Charge	0
Complexity	40

SMILES

CC(C)(CN)N

InChI

InChI=1S/C4H12N2/c1-4(2,6)3-5/h3,5-6H2,1-2H3

InChIKey

OPCJOXGBLDJWRM-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 811-93-8

CID: 13128

Formula: C4H12N2

MW: 88.15

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	88.15
XLogP3	-1
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	1
Exact Mass	88.100048391
Monoisotopic Mass	88.100048391
Topological Polar Surface Area	52 Å²
Heavy Atom Count	6
Formal Charge	0
Complexity	40.8
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
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OR322100	N-Methyl-1,3-propanediamine
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OR1042490-01	N,2-Dimethyl-1,3-propanediamine
OR941777-01	N, N,2,2-Tetramethyl-1,3-propanediamine
OR1014103-01	N, N-Bis (2-Hydroxybenzylidene) -1,2-Propanediamine
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OR75139-01	N- (2-Bromoethyl) -1,3-propanediamine dihydrobromide

Catalog	Name
sc-486230	2-Methyl-1,3-propanediamine
P25080-01	1,2-Propanediamine
FA168031-01	2- (Aminomethyl) -2-methyl-1,3-propanediamine trihydrochloride
sc-484654	N-Benzyl-2-methyl-1,3-propanediamine
sc-472528	N-Acetyl-2-methyl-1,3-propanediamine
sc-331592	N1- (2-Methoxyethyl) -N3-methyl-1,3-propanediamine
sc-331590	N1- (2-Furylmethyl) -N3-methyl-1,3-propanediamine
GL7180-5g	2,2-Dimethyl-1,3-propanediamine
sc-338340	N1-Methyl-N3- (tetrahydro-2-furanylmethyl) -1,3-propanediamine
459395-01	N-Methyl-1,3-propanediamine