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101804-01-7 | Phosphonic acid, P-(1-amino-1,2-dimethylpropyl)-
CAS No: 101804-01-7 Catalog No: AG0005M2 MDL No:
Product Description
Catalog Number:
AG0005M2
Chemical Name:
Phosphonic acid, P-(1-amino-1,2-dimethylpropyl)-
CAS Number:
101804-01-7
Molecular Formula:
C5H14NO3P
Molecular Weight:
167.1433
IUPAC Name:
(2-amino-3-methylbutan-2-yl)phosphonic acid;hydrate
InChI:
InChI=1S/C5H14NO3P.H2O/c1-4(2)5(3,6)10(7,8)9;/h4H,6H2,1-3H3,(H2,7,8,9);1H2
InChI Key:
YKZXVBDUXGJSRP-UHFFFAOYSA-N
SMILES:
CC(C(P(=O)(O)O)(N)C)C
Properties
Complexity:
164
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
185.082g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
4
Isotope Atom Count:
0
Molecular Weight:
185.16g/mol
Monoisotopic Mass:
185.082g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
84.6A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
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