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Home Aminos 4-(aminomethyl)-1,4-hexanediol acetate (salt)

4-(aminomethyl)-1,4-hexanediol acetate (salt)

CAS No.:
1609395-96-1
Catalog Number:
AG00J29B
Molecular Formula:
C9H21NO4
Molecular Weight:
207.2673
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
95%
In Stock USA
United States
$96
- +
5g
95%
In Stock USA
United States
$216
- +
Product Description
Catalog Number:
AG00J29B
Chemical Name:
4-(aminomethyl)-1,4-hexanediol acetate (salt)
CAS Number:
1609395-96-1
Molecular Formula:
C9H21NO4
Molecular Weight:
207.2673
MDL Number:
MFCD28024696
IUPAC Name:
acetic acid;4-(aminomethyl)hexane-1,4-diol
InChI:
InChI=1S/C7H17NO2.C2H4O2/c1-2-7(10,6-8)4-3-5-9;1-2(3)4/h9-10H,2-6,8H2,1H3;1H3,(H,3,4)
InChI Key:
YOCKHEYSUPFDBF-UHFFFAOYSA-N
SMILES:
CC(=O)O.OCCCC(CN)(CC)O
Properties
Complexity:
119  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
207.147g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
4  
Isotope Atom Count:
0
Molecular Weight:
207.27g/mol
Monoisotopic Mass:
207.147g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
104A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
Properties