Chem 1 Ethyl 3 3 Dimethylaminopropylcarbodiimide Hcl Gmfine

Compound 16
  CheckMol                        TMF02:r0:m0
MF=C8H18ClN3 MW=191.70
 12 10  0  0  0               999 V2000
    0.0000   -0.0000   -0.0000 Cl  0  0  0  0  0  0  0  0  0  0  0  0
   -4.1924    1.0248   -0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -3.6917    2.4456   -0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2375   -0.1165   -0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1909    3.8663   -0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7615   -1.5139   -0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.1691    5.0309   -0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8066   -2.6552   -0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.6684    6.4517   -0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3306   -4.0527   -0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -4.8213   -4.2972   -0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3757   -5.1939   -0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  2  3  2  0  0  0  0
  2  4  1  0  0  0  0
  3  5  2  0  0  0  0
  4  6  1  0  0  0  0
  5  7  1  0  0  0  0
  6  8  1  0  0  0  0
  7  9  1  0  0  0  0
  8 10  1  0  0  0  0
 10 11  1  0  0  0  0
 10 12  1  0  0  0  0
M  END

1-Ethyl-3-(3-dimethylaminopropyl)carbodiimide HCL

₹ 0.00 0.00

Chemical Name - 1-Ethyl-3-(3-dimethylaminopropyl)carbodiimide HCL
Mol Weight - 155.244
Smiles - CCN=C=NCCCN(C)C.Cl

Property Name	Property Value
Mol Name	1-Ethyl-3-(3-dimethylaminopropyl)carbodiimide HCL
Molweight	155.244
Monoisotopic Mass	155.142247
Clogp	0.4465
Clogs	-0.735
H Acceptors	3
Total Surface Area	151.16
Relative Psa	0.17577
Polar Surface Area	27.96
Druglikeness	1.7429
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Shape Index	0.90909
Molecular Flexibility	0.61867
Molecular Complexity	0.32189
Fragments	2
Non H Atoms	11
Non Ch Atoms	3
Electronegative Atoms	3
Stereo Centers	1
Rotatable Bonds	5
Sp3 Atoms	8
Symmetric Atoms	1
Amines	1
Alkyl Amines	1
Basic Nitrogens	3
Smiles	CCN=C=NCCCN(C)C.Cl
InChIKey	InChI=1S/C8H17N3.ClH/c1-4-9-8-10-6-5-7-11(2)3;/h4-7H2,1-3H3;1H
InChI	FPQQSJJWHUJYPU-UHFFFAOYSA-N

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1 - 1-Ethyl-3-(3-dimethylaminopropyl)carbodiimide HCL
2 - 1-Ethyl-3-(3-dimethylaminopropyl)carbodiimide HCL

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1-Ethyl-3-(3-dimethylaminopropyl)carbodiimide HCL