Carboplatin Impurity 25

CAT: 1299-RM-C021625-01Size: 10 mgDry Ice: NoHazardous: No

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CAT#:1299-RM-C021625-01Size:10 mg

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CAS Number

176445-78-6

Synonyms

1- (aminomethyl) -N, N-dimethylcyclobutan-1-amine

Molecular Formula

C7H16N2

Molecular Weight

128.22

Target Alternative Name

Carboplatin

Product Name Synonym

1- (aminomethyl) -N, N-dimethylcyclobutan-1-amine

Chemical Information

1-(aminomethyl)-N,N-dimethylcyclobutan-1-amine

CAS Number	176445-78-6
PubChem CID	10606763
IUPAC Name	1-(aminomethyl)-N,N-dimethylcyclobutan-1-amine
Molecular Formula	C7H16N2
Molecular Weight	128.22
XLogP	0.1
Topological Polar Surface Area	29.3
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	2
Heavy Atom Count	9
Formal Charge	0
Complexity	95

SMILES

CN(C)C1(CCC1)CN

InChI

InChI=1S/C7H16N2/c1-9(2)7(6-8)4-3-5-7/h3-6,8H2,1-2H3

InChIKey

OJICYCRCZTYFAV-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 176445-78-6

CID: 10606763

Formula: C7H16N2

MW: 128.22

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	128.22
XLogP3	0.1
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	2
Exact Mass	128.131348519
Monoisotopic Mass	128.131348519
Topological Polar Surface Area	29.3 Å²
Heavy Atom Count	9
Formal Charge	0
Complexity	95.1
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